3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 3-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 3-[(3-butoxybenzoyl)thiocarbamoylamino]-N-(1-phenylethyl)benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-3-4-16-33-24-15-9-13-22(18-24)26(32)30-27(34)29-23-14-8-12-21(17-23)25(31)28-19(2)20-10-6-5-7-11-20/h5-15,17-19H,3-4,16H2,1-2H3,(H,28,31)(H2,29,30,32,34)