N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]-2-cyano-ethanamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]-2-cyano-ethanamide Openeye Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-2-cyano-acetamide CAS Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]-2-cyanoacetamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-2-cyanoacetamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]-2-cyano-acetamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)NC(=O)CC#N

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)NC(=O)CC#N

InChI

InChI=1S/C22H20N4O2S/c23-12-9-20(27)24-17-7-5-16(6-8-17)22(28)26-13-10-15(11-14-26)21-25-18-3-1-2-4-19(18)29-21/h1-8,15H,9-11,13-14H2,(H,24,27)