2-[[2-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-(4-phenylazanylphenyl)benzamide

Systemtic Name: 2-[[2-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-(4-phenylazanylphenyl)benzamide Openeye Name: N-(4-anilinophenyl)-2-[(2-isobutoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(4-anilinophenyl)-2-[[[[[2-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-anilinophenyl)-2-[[2-(2-methylpropoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-(4-anilinophenyl)-2-[(2-isobutoxybenzoyl)thiocarbamoylamino]benzamide Formula: C31H30N4O3S MolecularWeight: 538.6599

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C31H30N4O3S/c1-21(2)20-38-28-15-9-7-13-26(28)30(37)35-31(39)34-27-14-8-6-12-25(27)29(36)33-24-18-16-23(17-19-24)32-22-10-4-3-5-11-22/h3-19,21,32H,20H2,1-2H3,(H,33,36)(H2,34,35,37,39)