N-[(5-azanyl-4-cyano-3-phenyl-2,3-dihydrothiophen-2-yl)carbonyl]pyrrolidine-1-carboxamide

Systemtic Name: N-[(5-azanyl-4-cyano-3-phenyl-2,3-dihydrothiophen-2-yl)carbonyl]pyrrolidine-1-carboxamide Openeye Name: N-(5-amino-4-cyano-3-phenyl-2,3-dihydrothiophene-2-carbonyl)pyrrolidine-1-carboxamide CAS Name: N-[(5-amino-4-cyano-3-phenyl-2,3-dihydrothiophen-2-yl)-oxomethyl]-1-pyrrolidinecarboxamide IUPAC Name: N-(5-amino-4-cyano-3-phenyl-2,3-dihydrothiophene-2-carbonyl)pyrrolidine-1-carboxamide Traditional Name: N-(5-amino-4-cyano-3-phenyl-2,3-dihydrothiophene-2-carbonyl)pyrrolidine-1-carboxamide Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)NC(=O)C2C(C(=C(S2)N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2S/c18-10-12-13(11-6-2-1-3-7-11)14(24-15(12)19)16(22)20-17(23)21-8-4-5-9-21/h1-3,6-7,13-14H,4-5,8-9,19H2,(H,20,22,23)