2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]thio]methyl]-6-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-6-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[[5,6-bis(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]thio]methyl]-6-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C29H27N5O5S MolecularWeight: 557.62018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CSC3=NC(=C(N=N3)C4=CC(=C(C=C4)OC)OC)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CSC3=NC(=C(N=N3)C4=CC(=C(C=C4)OC)OC)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C29H27N5O5S/c1-17-7-6-8-25-30-20(15-26(35)34(17)25)16-40-29-31-27(18-9-11-21(36-2)23(13-18)38-4)28(32-33-29)19-10-12-22(37-3)24(14-19)39-5/h6-15H,16H2,1-5H3