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

Systemtic Name: N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]-4-isopropyl-benzamide Formula: C22H26ClN3OS MolecularWeight: 415.97934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3OS/c1-15(2)16-9-11-17(12-10-16)21(27)25-22(28)24-19-8-6-7-18(23)20(19)26-13-4-3-5-14-26/h6-12,15H,3-5,13-14H2,1-2H3,(H2,24,25,27,28)