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

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]indolizine-1-carbonitrile Openeye Name: 2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]indolizine-1-carbonitrile CAS Name: 2-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]indolizine-1-carbonitrile Traditional Name: 2-[[(1-phenyltetrazol-5-yl)thio]methyl]indolizine-1-carbonitrile Formula: C17H12N6S MolecularWeight: 332.38238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C17H12N6S/c18-10-15-13(11-22-9-5-4-8-16(15)22)12-24-17-19-20-21-23(17)14-6-2-1-3-7-14/h1-9,11H,12H2