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

Systemtic Name: N-[3-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]phenyl]-3-chloranyl-benzamide Openeye Name: 3-chloro-N-[3-[(4-sec-butoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: N-[3-[[[[(4-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-chlorobenzamide IUPAC Name: N-[3-[(4-butan-2-yloxybenzoyl)carbamothioylamino]phenyl]-3-chlorobenzamide Traditional Name: 3-chloro-N-[3-[(4-sec-butoxybenzoyl)thiocarbamoylamino]phenyl]benzamide Formula: C25H24ClN3O3S MolecularWeight: 481.99436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24ClN3O3S/c1-3-16(2)32-22-12-10-17(11-13-22)23(30)29-25(33)28-21-9-5-8-20(15-21)27-24(31)18-6-4-7-19(26)14-18/h4-16H,3H2,1-2H3,(H,27,31)(H2,28,29,30,33)