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

Systemtic Name: 3-methyl-N-[4-[[3-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: N-[4-[(3-isopentyloxybenzoyl)carbamothioylamino]phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[[[[[3-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-methyl-N-[4-[[3-(3-methylbutoxy)benzoyl]carbamothioylamino]phenyl]benzamide Traditional Name: N-[4-[(3-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(=CC=C3)OCCC(C)C

Isomeric SMILES

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

InChI

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