2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[[4-(3-methylbutoxy)phenyl]carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(4-isopentyloxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[[4-(3-methylbutoxy)benzoyl]carbamothioylamino]benzamide Traditional Name: N-benzyl-2-[(4-isoamoxybenzoyl)thiocarbamoylamino]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-19(2)16-17-33-22-14-12-21(13-15-22)25(31)30-27(34)29-24-11-7-6-10-23(24)26(32)28-18-20-8-4-3-5-9-20/h3-15,19H,16-18H2,1-2H3,(H,28,32)(H2,29,30,31,34)