2-methyl-5-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-methyl-5-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-methyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-methyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]thio]-1H-pyrimidin-6-one Formula: C18H14N6OS MolecularWeight: 362.40836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=O)N1)SC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

Isomeric SMILES

CC1=NC=C(C(=O)N1)SC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

InChI

InChI=1S/C18H14N6OS/c1-11-19-10-16(18(25)20-11)26-13-7-8-14(12-5-3-2-4-6-12)15(9-13)17-21-23-24-22-17/h2-10H,1H3,(H,19,20,25)(H,21,22,23,24)