2-[methyl-[(4-propoxyphenyl)carbonylcarbamothioyl]amino]-N-phenethyl-benzamide

Systemtic Name: 2-[methyl-[(4-propoxyphenyl)carbonylcarbamothioyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[methyl-[(4-propoxybenzoyl)carbamothioyl]amino]-N-phenethyl-benzamide CAS Name: 2-[methyl-[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[methyl-[(4-propoxybenzoyl)carbamothioyl]amino]-N-phenethylbenzamide Traditional Name: 2-[methyl-[(4-propoxybenzoyl)thiocarbamoyl]amino]-N-phenethyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

InChI

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