(2R,3R)-5-azanyl-4-cyano-3-(4-methoxyphenyl)-N-[(4-methylphenyl)carbamoyl]-2,3-dihydrothiophene-2-carboxamide

Systemtic Name: (2R,3R)-5-azanyl-4-cyano-3-(4-methoxyphenyl)-N-[(4-methylphenyl)carbamoyl]-2,3-dihydrothiophene-2-carboxamide Openeye Name: (2R,3R)-5-amino-4-cyano-3-(4-methoxyphenyl)-N-(p-tolylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide CAS Name: (2R,3R)-5-amino-4-cyano-3-(4-methoxyphenyl)-N-[(4-methylanilino)-oxomethyl]-2,3-dihydrothiophene-2-carboxamide IUPAC Name: (2R,3R)-5-amino-4-cyano-3-(4-methoxyphenyl)-N-[(4-methylphenyl)carbamoyl]-2,3-dihydrothiophene-2-carboxamide Traditional Name: (2R,3R)-5-amino-4-cyano-3-(4-methoxyphenyl)-N-(p-tolylcarbamoyl)-2,3-dihydrothiophene-2-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC(=O)[C@H]2[C@@H](C(=C(S2)N)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20N4O3S/c1-12-3-7-14(8-4-12)24-21(27)25-20(26)18-17(16(11-22)19(23)29-18)13-5-9-15(28-2)10-6-13/h3-10,17-18H,23H2,1-2H3,(H2,24,25,26,27)/t17-,18-/m1/s1