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

Systemtic Name: 3-[[3-(2-ethoxyethoxy)phenyl]carbonylcarbamothioylamino]-N-ethyl-N-phenyl-benzamide Openeye Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-ethyl-N-phenyl-benzamide CAS Name: 3-[[[[[3-(2-ethoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-ethyl-N-phenylbenzamide IUPAC Name: 3-[[3-(2-ethoxyethoxy)benzoyl]carbamothioylamino]-N-ethyl-N-phenylbenzamide Traditional Name: 3-[[3-(2-ethoxyethoxy)benzoyl]thiocarbamoylamino]-N-ethyl-N-phenyl-benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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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(=CC=C3)OCCOCC

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O4S/c1-3-30(23-13-6-5-7-14-23)26(32)21-11-8-12-22(18-21)28-27(35)29-25(31)20-10-9-15-24(19-20)34-17-16-33-4-2/h5-15,18-19H,3-4,16-17H2,1-2H3,(H2,28,29,31,35)