methyl 2-[[3-(dimethylamino)propyl-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]carbamothioyl]amino]benzoate

Systemtic Name: methyl 2-[[3-(dimethylamino)propyl-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]carbamothioyl]amino]benzoate Openeye Name: methyl 2-[[3-(dimethylamino)propyl-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]carbamothioyl]amino]benzoate CAS Name: 2-[[[3-(dimethylamino)propyl-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-(dimethylamino)propyl-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]carbamothioyl]amino]benzoate Traditional Name: 2-[[3-(dimethylamino)propyl-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]thiocarbamoyl]amino]benzoic acid methyl ester Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CC1=CC2=C(C=C(C=C2)OC)NC1=O)C(=S)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CN(C)CCCN(CC1=CC2=C(C=C(C=C2)OC)NC1=O)C(=S)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C25H30N4O4S/c1-28(2)12-7-13-29(25(34)27-21-9-6-5-8-20(21)24(31)33-4)16-18-14-17-10-11-19(32-3)15-22(17)26-23(18)30/h5-6,8-11,14-15H,7,12-13,16H2,1-4H3,(H,26,30)(H,27,34)