2-[methyl-[(4-propan-2-yloxyphenyl)carbonylcarbamothioyl]amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[methyl-[(4-propan-2-yloxyphenyl)carbonylcarbamothioyl]amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(4-isopropoxybenzoyl)carbamothioyl-methyl-amino]benzamide CAS Name: 2-[methyl-[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[methyl-[(4-propan-2-yloxybenzoyl)carbamothioyl]amino]benzamide Traditional Name: N-benzyl-2-[(4-isopropoxybenzoyl)thiocarbamoyl-methyl-amino]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)32-21-15-13-20(14-16-21)24(30)28-26(33)29(3)23-12-8-7-11-22(23)25(31)27-17-19-9-5-4-6-10-19/h4-16,18H,17H2,1-3H3,(H,27,31)(H,28,30,33)