N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: N-[[4-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[4-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: N-[[4-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]-3-(2-ethoxyethoxy)benzamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

InChI

InChI=1S/C25H31N3O4S/c1-2-31-15-16-32-22-10-6-7-19(17-22)24(30)28-25(33)27-21-13-11-18(12-14-21)23(29)26-20-8-4-3-5-9-20/h6-7,10-14,17,20H,2-5,8-9,15-16H2,1H3,(H,26,29)(H2,27,28,30,33)