9-methyl-4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrido[1,2-a]pyrimidine-3-carbaldehyde

Systemtic Name: 9-methyl-4-oxidanylidene-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyrido[1,2-a]pyrimidine-3-carbaldehyde Openeye Name: 9-methyl-4-oxo-2-(1-phenyltetrazol-5-yl)sulfanyl-pyrido[1,2-a]pyrimidine-3-carbaldehyde CAS Name: 9-methyl-4-oxo-2-[(1-phenyl-5-tetrazolyl)thio]-3-pyrido[1,2-a]pyrimidinecarboxaldehyde IUPAC Name: 9-methyl-4-oxo-2-(1-phenyltetrazol-5-yl)sulfanylpyrido[1,2-a]pyrimidine-3-carbaldehyde Traditional Name: 4-keto-9-methyl-2-[(1-phenyltetrazol-5-yl)thio]pyrido[1,2-a]pyrimidine-3-carbaldehyde Formula: C17H12N6O2S MolecularWeight: 364.38118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=O)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=O)SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H12N6O2S/c1-11-6-5-9-22-14(11)18-15(13(10-24)16(22)25)26-17-19-20-21-23(17)12-7-3-2-4-8-12/h2-10H,1H3