3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-ethyl-N-phenyl-benzamide

Systemtic Name: 3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-ethyl-N-phenyl-benzamide Openeye Name: 3-[(4-tert-butylbenzoyl)carbamothioylamino]-N-ethyl-N-phenyl-benzamide CAS Name: 3-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-ethyl-N-phenylbenzamide IUPAC Name: 3-[(4-tert-butylbenzoyl)carbamothioylamino]-N-ethyl-N-phenylbenzamide Traditional Name: 3-[(4-tert-butylbenzoyl)thiocarbamoylamino]-N-ethyl-N-phenyl-benzamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O2S/c1-5-30(23-12-7-6-8-13-23)25(32)20-10-9-11-22(18-20)28-26(33)29-24(31)19-14-16-21(17-15-19)27(2,3)4/h6-18H,5H2,1-4H3,(H2,28,29,31,33)