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

Systemtic Name: N-[[5-azanyl-4-cyano-3-(4-methylphenyl)-2,3-dihydrothiophen-2-yl]carbonyl]pyrrolidine-1-carboxamide Openeye Name: N-[5-amino-4-cyano-3-(p-tolyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide CAS Name: N-[[5-amino-4-cyano-3-(4-methylphenyl)-2,3-dihydrothiophen-2-yl]-oxomethyl]-1-pyrrolidinecarboxamide IUPAC Name: N-[5-amino-4-cyano-3-(4-methylphenyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide Traditional Name: N-[5-amino-4-cyano-3-(p-tolyl)-2,3-dihydrothiophene-2-carbonyl]pyrrolidine-1-carboxamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(SC(=C2C#N)N)C(=O)NC(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2C(SC(=C2C#N)N)C(=O)NC(=O)N3CCCC3

InChI

InChI=1S/C18H20N4O2S/c1-11-4-6-12(7-5-11)14-13(10-19)16(20)25-15(14)17(23)21-18(24)22-8-2-3-9-22/h4-7,14-15H,2-3,8-9,20H2,1H3,(H,21,23,24)