N-[4-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]phenyl]-3-methyl-benzamide Openeye Name: 3-methyl-N-[4-[(3-sec-butoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: N-[4-[[[[(3-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[(3-butan-2-yloxybenzoyl)carbamothioylamino]phenyl]-3-methylbenzamide Traditional Name: 3-methyl-N-[4-[(3-sec-butoxybenzoyl)thiocarbamoylamino]phenyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O3S/c1-4-18(3)32-23-10-6-9-20(16-23)25(31)29-26(33)28-22-13-11-21(12-14-22)27-24(30)19-8-5-7-17(2)15-19/h5-16,18H,4H2,1-3H3,(H,27,30)(H2,28,29,31,33)