4-[(2S)-butan-2-yl]oxy-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-[(2S)-butan-2-yl]oxy-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]benzamide Openeye Name: N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-4-[(1S)-1-methylpropoxy]benzamide CAS Name: 4-[(2S)-butan-2-yl]oxy-N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-[(2S)-butan-2-yl]oxy-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-4-[(1S)-1-methylpropoxy]benzamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

Isomeric SMILES

CC[C@H](C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

InChI

InChI=1S/C23H28ClN3O2S/c1-3-16(2)29-19-10-7-17(8-11-19)22(28)26-23(30)25-18-9-12-21(20(24)15-18)27-13-5-4-6-14-27/h7-12,15-16H,3-6,13-14H2,1-2H3,(H2,25,26,28,30)/t16-/m0/s1