(2R,3R)-5-azanyl-3-(4-bromophenyl)-4-cyano-N-(phenylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide

Systemtic Name: (2R,3R)-5-azanyl-3-(4-bromophenyl)-4-cyano-N-(phenylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide Openeye Name: (2R,3R)-5-amino-3-(4-bromophenyl)-4-cyano-N-(phenylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide CAS Name: (2R,3R)-5-amino-N-[anilino(oxo)methyl]-3-(4-bromophenyl)-4-cyano-2,3-dihydrothiophene-2-carboxamide IUPAC Name: (2R,3R)-5-amino-3-(4-bromophenyl)-4-cyano-N-(phenylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide Traditional Name: (2R,3R)-5-amino-3-(4-bromophenyl)-4-cyano-N-(phenylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide Formula: C19H15BrN4O2S MolecularWeight: 443.317

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC(=O)[C@H]2[C@@H](C(=C(S2)N)C#N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H15BrN4O2S/c20-12-8-6-11(7-9-12)15-14(10-21)17(22)27-16(15)18(25)24-19(26)23-13-4-2-1-3-5-13/h1-9,15-16H,22H2,(H2,23,24,25,26)/t15-,16-/m1/s1