3-methyl-N-[4-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 3-methyl-N-[4-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: N-[4-[(4-isopentyloxybenzoyl)carbamothioylamino]phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]phenyl]benzamide Traditional Name: N-[4-[(4-isoamoxybenzoyl)thiocarbamoylamino]phenyl]-3-methyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)OCCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)OCCC(C)C

InChI

InChI=1S/C27H29N3O3S/c1-18(2)15-16-33-24-13-7-20(8-14-24)25(31)30-27(34)29-23-11-9-22(10-12-23)28-26(32)21-6-4-5-19(3)17-21/h4-14,17-18H,15-16H2,1-3H3,(H,28,32)(H2,29,30,31,34)