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

Systemtic Name: 2-[methyl-[(2-pentoxyphenyl)carbonylcarbamothioyl]amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[methyl-[(2-pentoxybenzoyl)carbamothioyl]amino]benzamide CAS Name: 2-[methyl-[[[oxo-(2-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[methyl-[(2-pentoxybenzoyl)carbamothioyl]amino]benzamide Traditional Name: 2-[(2-amoxybenzoyl)thiocarbamoyl-methyl-amino]-N-benzyl-benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C28H31N3O3S/c1-3-4-12-19-34-25-18-11-9-16-23(25)27(33)30-28(35)31(2)24-17-10-8-15-22(24)26(32)29-20-21-13-6-5-7-14-21/h5-11,13-18H,3-4,12,19-20H2,1-2H3,(H,29,32)(H,30,33,35)