N-methyl-4-[(4-pentoxyphenyl)carbonylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-methyl-4-[(4-pentoxyphenyl)carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-methyl-4-[(4-pentoxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: N-methyl-4-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-methyl-4-[(4-pentoxybenzoyl)carbamothioylamino]-N-phenylbenzamide Traditional Name: 4-[(4-amoxybenzoyl)thiocarbamoylamino]-N-methyl-N-phenyl-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=C(C=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(C)C3=CC=CC=C3

InChI

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