N-[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propyl-carbamothioyl]benzamide

Systemtic Name: N-[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propyl-carbamothioyl]benzamide Openeye Name: N-[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propyl-carbamothioyl]benzamide CAS Name: N-[[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propylcarbamothioyl]benzamide Traditional Name: N-[[cyclopropyl-[4-(1-hydroxyethyl)phenyl]methyl]-propyl-thiocarbamoyl]benzamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(C1CC1)C2=CC=C(C=C2)C(C)O)C(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN(C(C1CC1)C2=CC=C(C=C2)C(C)O)C(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S/c1-3-15-25(23(28)24-22(27)20-7-5-4-6-8-20)21(19-13-14-19)18-11-9-17(10-12-18)16(2)26/h4-12,16,19,21,26H,3,13-15H2,1-2H3,(H,24,27,28)