(3-methyl-1-methylsulfanyl-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl)-phenyl-methanone

Systemtic Name: (3-methyl-1-methylsulfanyl-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl)-phenyl-methanone Openeye Name: (3-methyl-1-methylsulfanyl-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl)-phenyl-methanone CAS Name: [3-methyl-1-(methylthio)-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl]-phenylmethanone IUPAC Name: (3-methyl-1-methylsulfanyl-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl)-phenylmethanone Traditional Name: [3-methyl-1-(methylthio)-3,4,4a,5-tetrahydropyrimido[1,6-a]benzimidazol-8-yl]-phenyl-methanone Formula: C19H19N3OS MolecularWeight: 337.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2NC3=C(N2C(=N1)SC)C=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CC2NC3=C(N2C(=N1)SC)C=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3OS/c1-12-10-17-21-15-9-8-14(18(23)13-6-4-3-5-7-13)11-16(15)22(17)19(20-12)24-2/h3-9,11-12,17,21H,10H2,1-2H3