1-methyl-6-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)prop-2-ynyl]-3-(phenylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione

Systemtic Name: 1-methyl-6-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)prop-2-ynyl]-3-(phenylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione Openeye Name: 3-benzyl-1-methyl-6-[3-(1-methyltetrazol-5-yl)prop-2-ynyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione CAS Name: 1-methyl-6-[3-(1-methyl-5-tetrazolyl)prop-2-ynyl]-3-(phenylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione IUPAC Name: 3-benzyl-1-methyl-6-[3-(1-methyltetrazol-5-yl)prop-2-ynyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-dione Traditional Name: 3-benzyl-1-methyl-6-[3-(1-methyltetrazol-5-yl)prop-2-ynyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-quinone Formula: C20H21N7O2 MolecularWeight: 391.42644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(CC2)CC#CC3=NN=NN3C)C(=O)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(CN(CC2)CC#CC3=NN=NN3C)C(=O)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H21N7O2/c1-24-17-10-12-26(11-6-9-18-21-22-23-25(18)2)14-16(17)19(28)27(20(24)29)13-15-7-4-3-5-8-15/h3-5,7-8H,10-14H2,1-2H3