4-bromanyl-N-(6-methoxy-2,2,4-trimethyl-quinolin-1-yl)carbothioyl-benzamide

Systemtic Name: 4-bromanyl-N-(6-methoxy-2,2,4-trimethyl-quinolin-1-yl)carbothioyl-benzamide Openeye Name: 4-bromo-N-(6-methoxy-2,2,4-trimethyl-quinoline-1-carbothioyl)benzamide CAS Name: 4-bromo-N-[(6-methoxy-2,2,4-trimethyl-1-quinolinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-(6-methoxy-2,2,4-trimethylquinoline-1-carbothioyl)benzamide Traditional Name: 4-bromo-N-(6-methoxy-2,2,4-trimethyl-quinoline-1-carbothioyl)benzamide Formula: C21H21BrN2O2S MolecularWeight: 445.37264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC)C(=S)NC(=O)C3=CC=C(C=C3)Br)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC)C(=S)NC(=O)C3=CC=C(C=C3)Br)(C)C

InChI

InChI=1S/C21H21BrN2O2S/c1-13-12-21(2,3)24(18-10-9-16(26-4)11-17(13)18)20(27)23-19(25)14-5-7-15(22)8-6-14/h5-12H,1-4H3,(H,23,25,27)