N-(3,4-dimethylphenyl)-2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3,4-dimethylphenyl)-2-[(4-heptoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3,4-dimethylphenyl)-2-[[[[(4-heptoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[(4-heptoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3,4-dimethylphenyl)-2-[(4-heptoxybenzoyl)thiocarbamoylamino]benzamide Formula: C30H35N3O3S MolecularWeight: 517.6822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C30H35N3O3S/c1-4-5-6-7-10-19-36-25-17-14-23(15-18-25)28(34)33-30(37)32-27-12-9-8-11-26(27)29(35)31-24-16-13-21(2)22(3)20-24/h8-9,11-18,20H,4-7,10,19H2,1-3H3,(H,31,35)(H2,32,33,34,37)