N-(3-methylphenyl)-3-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-methylphenyl)-3-[(4-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(m-tolyl)-3-[(4-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-methylphenyl)-3-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-methylphenyl)-3-[(4-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(m-tolyl)-3-[(4-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C25H25N3O3S/c1-3-14-31-22-12-10-18(11-13-22)23(29)28-25(32)27-21-9-5-7-19(16-21)24(30)26-20-8-4-6-17(2)15-20/h4-13,15-16H,3,14H2,1-2H3,(H,26,30)(H2,27,28,29,32)