3-butoxy-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-(2-methyl-1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-(2-methyl-1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-(2-methylpiperidino)phenyl]thiocarbamoyl]benzamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3C

InChI

InChI=1S/C24H31N3O2S/c1-3-4-16-29-22-10-7-9-19(17-22)23(28)26-24(30)25-20-11-13-21(14-12-20)27-15-6-5-8-18(27)2/h7,9-14,17-18H,3-6,8,15-16H2,1-2H3,(H2,25,26,28,30)