| SpectraBase Spectrum ID |
3ZRbATjXTcb |
| Name |
1-[(2R,3R)-5-Amino-4-cyano-3-(phenyl)-2,3-dihydro-thiophene-2-carbonyl]-3-(4-chloro-phenyl)-urea |
| Alternate Name(s) |
4-Cyano-5-amino-2-[N'-(N''-p-chlorophenylaminocarbonyl)aminocarbonyl]-3-phenyl-2,3-dihydrothiophene
(2R,3R)-5-amino-N-[(4-chloroanilino)-oxomethyl]-4-cyano-3-phenyl-2,3-dihydrothiophene-2-carboxamide
(2R,3R)-5-azanyl-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-phenyl-2,3-dihydrothiophene-2-carboxamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H15ClN4O2S |
| InChI |
InChI=1S/C19H15ClN4O2S/c20-12-6-8-13(9-7-12)23-19(26)24-18(25)16-15(11-4-2-1-3-5-11)14(10-21)17(22)27-16/h1-9,15-16H,22H2,(H2,23,24,25,26)/t15-,16-/m1/s1 |
| InChIKey |
KHUATVVZZGMPIU-HZPDHXFCSA-N |
| Molecular Weight |
398.868 g/mol |
| SMILES |
N(C([C@]1([C@@](C(=C(S1)N)C#N)(c1ccccc1)[H])[H])=O)C(Nc1ccc(cc1)Cl)=O |
| SPLASH |
splash10-0002-0009000000-bf6d16e8b70ace3072c4 |
| Source of Spectrum |
U1-2009-5251-2a |
| Wiley ID |
1697163 |
![1-[(2R,3R)-5-Amino-4-cyano-3-(phenyl)-2,3-dihydro-thiophene-2-carbonyl]-3-(4-chloro-phenyl)-urea](/api/spectrum/3ZRbATjXTcb/structure.png?h=300&w=458 "1-[(2R,3R)-5-Amino-4-cyano-3-(phenyl)-2,3-dihydro-thiophene-2-carbonyl]-3-(4-chloro-phenyl)-urea")
