N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanamide

Systemtic Name: N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-3-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)propanamide Openeye Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]-3-(4,8-dimethyl-2-oxo-1-quinolyl)propanamide CAS Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thiophenyl]-3-(4,8-dimethyl-2-oxo-1-quinolinyl)propanamide IUPAC Name: N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]-3-(4,8-dimethyl-2-oxoquinolin-1-yl)propanamide Traditional Name: N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]-3-(2-keto-4,8-dimethyl-1-quinolyl)propionamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C=C2C)CCC(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C=C2C)CCC(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C26H23N3O3S/c1-16-5-4-6-20-17(2)13-24(31)29(25(16)20)12-11-23(30)28-26-21(14-27)22(15-33-26)18-7-9-19(32-3)10-8-18/h4-10,13,15H,11-12H2,1-3H3,(H,28,30)