N-methyl-N-(phenylmethyl)-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-methyl-N-(phenylmethyl)-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-benzyl-3-[(4-isopropoxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: N-methyl-3-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-methyl-3-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-3-[(4-isopropoxybenzoyl)thiocarbamoylamino]-N-methyl-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)NC2=CC=CC(=C2)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)CC3=CC=CC=C3

InChI

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