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

Systemtic Name: 2-[methyl-[(2-pentoxyphenyl)carbonylcarbamothioyl]amino]-N-phenethyl-benzamide Openeye Name: 2-[methyl-[(2-pentoxybenzoyl)carbamothioyl]amino]-N-phenethyl-benzamide CAS Name: 2-[methyl-[[[oxo-(2-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[methyl-[(2-pentoxybenzoyl)carbamothioyl]amino]-N-phenethylbenzamide Traditional Name: 2-[(2-amoxybenzoyl)thiocarbamoyl-methyl-amino]-N-phenethyl-benzamide Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C29H33N3O3S/c1-3-4-12-21-35-26-18-11-9-16-24(26)28(34)31-29(36)32(2)25-17-10-8-15-23(25)27(33)30-20-19-22-13-6-5-7-14-22/h5-11,13-18H,3-4,12,19-21H2,1-2H3,(H,30,33)(H,31,34,36)