N-[3-cyano-4-[(phenylmethyl)amino]quinolin-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-cyano-4-[(phenylmethyl)amino]quinolin-2-yl]thiophene-2-carboxamide Openeye Name: N-[4-(benzylamino)-3-cyano-2-quinolyl]thiophene-2-carboxamide CAS Name: N-[3-cyano-4-[(phenylmethyl)amino]-2-quinolinyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(benzylamino)-3-cyanoquinolin-2-yl]thiophene-2-carboxamide Traditional Name: N-[4-(benzylamino)-3-cyano-2-quinolyl]thiophene-2-carboxamide Formula: C22H16N4OS MolecularWeight: 384.45364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC3=CC=CC=C32)NC(=O)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC3=CC=CC=C32)NC(=O)C4=CC=CS4)C#N

InChI

InChI=1S/C22H16N4OS/c23-13-17-20(24-14-15-7-2-1-3-8-15)16-9-4-5-10-18(16)25-21(17)26-22(27)19-11-6-12-28-19/h1-12H,14H2,(H2,24,25,26,27)