1,3-dimethyl-5-(4-methylphenyl)-8-thiophen-2-yl-9H-pyrimido[5,4-d][1,2]diazepine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-(4-methylphenyl)-8-thiophen-2-yl-9H-pyrimido[5,4-d][1,2]diazepine-2,4-dione Openeye Name: 1,3-dimethyl-5-(p-tolyl)-8-(2-thienyl)-9H-pyrimido[5,4-d]diazepine-2,4-dione CAS Name: 1,3-dimethyl-5-(4-methylphenyl)-8-thiophen-2-yl-9H-pyrimido[5,4-d]diazepine-2,4-dione IUPAC Name: 1,3-dimethyl-5-(4-methylphenyl)-8-thiophen-2-yl-9H-pyrimido[5,4-d]diazepine-2,4-dione Traditional Name: 1,3-dimethyl-5-(p-tolyl)-8-(2-thienyl)-9H-pyrimido[5,4-d]diazepine-2,4-quinone Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(CC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(CC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CS4

InChI

InChI=1S/C20H18N4O2S/c1-12-6-8-13(9-7-12)18-17-15(23(2)20(26)24(3)19(17)25)11-14(21-22-18)16-5-4-10-27-16/h4-10H,11H2,1-3H3