N-ethyl-2-[[3-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-ethyl-2-[[3-(2-methylpropoxy)phenyl]carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-2-[(3-isobutoxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-2-[[[[[3-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-2-[[3-(2-methylpropoxy)benzoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-2-[(3-isobutoxybenzoyl)thiocarbamoylamino]-N-phenyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C27H29N3O3S/c1-4-30(21-12-6-5-7-13-21)26(32)23-15-8-9-16-24(23)28-27(34)29-25(31)20-11-10-14-22(17-20)33-18-19(2)3/h5-17,19H,4,18H2,1-3H3,(H2,28,29,31,34)