8-[(3-methylphenyl)methyl]-3-(thiophen-2-ylmethyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione

Systemtic Name: 8-[(3-methylphenyl)methyl]-3-(thiophen-2-ylmethyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione Openeye Name: 8-(m-tolylmethyl)-3-(2-thienylmethyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione CAS Name: 8-[(3-methylphenyl)methyl]-3-(thiophen-2-ylmethyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione IUPAC Name: 8-[(3-methylphenyl)methyl]-3-(thiophen-2-ylmethyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-dione Traditional Name: 8-(3-methylbenzyl)-3-(2-thenyl)-1H-pyrido[2,3-d]pyrimidin-8-ium-2,4-quinone Formula: C20H18N3O2S+ MolecularWeight: 364.44082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[N+]2=CC=CC3=C2NC(=O)N(C3=O)CC4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)C[N+]2=CC=CC3=C2NC(=O)N(C3=O)CC4=CC=CS4

InChI

InChI=1S/C20H17N3O2S/c1-14-5-2-6-15(11-14)12-22-9-3-8-17-18(22)21-20(25)23(19(17)24)13-16-7-4-10-26-16/h2-11H,12-13H2,1H3/p+1