2-[(4-pentoxyphenyl)carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[(4-pentoxyphenyl)carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(4-amoxybenzoyl)thiocarbamoylamino]-N-benzyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-9-18-33-22-16-14-21(15-17-22)25(31)30-27(34)29-24-13-8-7-12-23(24)26(32)28-19-20-10-5-4-6-11-20/h4-8,10-17H,2-3,9,18-19H2,1H3,(H,28,32)(H2,29,30,31,34)