2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromopyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one Formula: C17H19BrN6OS MolecularWeight: 435.34136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C17H19BrN6OS/c18-12-6-7-14-20-13(8-15(25)23(14)9-12)10-26-17-22-21-16(24(17)19)11-4-2-1-3-5-11/h6-9,11H,1-5,10,19H2