6-ethylsulfonyl-4-(4-methylphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Systemtic Name: 6-ethylsulfonyl-4-(4-methylphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 6-ethylsulfonyl-4-(4-methylphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 6-ethylsulfonyl-4-(4-methylphenoxy)-2-(4-methyl-1-piperazinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 6-ethylsulfonyl-4-(4-methylphenoxy)-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 6-esyl-4-(4-methylphenoxy)-2-(4-methylpiperazino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C21H29N5O3S MolecularWeight: 431.55166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C(=NC(=N2)N3CCN(CC3)C)OC4=CC=C(C=C4)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C(=NC(=N2)N3CCN(CC3)C)OC4=CC=C(C=C4)C

InChI

InChI=1S/C21H29N5O3S/c1-4-30(27,28)26-10-9-19-18(15-26)20(29-17-7-5-16(2)6-8-17)23-21(22-19)25-13-11-24(3)12-14-25/h5-8H,4,9-15H2,1-3H3