2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]indolizine-1-carbonitrile

Systemtic Name: 2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]indolizine-1-carbonitrile Openeye Name: 2-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanylmethyl]indolizine-1-carbonitrile CAS Name: 2-[[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanylmethyl]indolizine-1-carbonitrile Traditional Name: 2-[[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]methyl]indolizine-1-carbonitrile Formula: C23H22N6S MolecularWeight: 414.52598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CN5C=CC=CC5=C4C#N

Isomeric SMILES

C1CCN(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CN5C=CC=CC5=C4C#N

InChI

InChI=1S/C23H22N6S/c24-15-20-18(16-28-14-8-5-11-21(20)28)17-30-23-26-25-22(27-12-6-2-7-13-27)29(23)19-9-3-1-4-10-19/h1,3-5,8-11,14,16H,2,6-7,12-13,17H2