N-[(Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]-3,4-dimethyl-benzamide

Systemtic Name: N-[(Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-1-thiophen-2-yl-prop-1-en-2-yl]-3,4-dimethyl-benzamide Openeye Name: N-[(Z)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide CAS Name: N-[(Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide IUPAC Name: N-[(Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]-3,4-dimethylbenzamide Traditional Name: N-[(Z)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-(2-thienyl)vinyl]-3,4-dimethyl-benzamide Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=CC2=CC=CS2)C(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/C(=C\C2=CC=CS2)/C(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C25H24N2O2S/c1-17-9-10-20(14-18(17)2)24(28)26-23(15-22-8-5-13-30-22)25(29)27-12-11-19-6-3-4-7-21(19)16-27/h3-10,13-15H,11-12,16H2,1-2H3,(H,26,28)/b23-15-