5,6-dimethyl-3-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-[(3-nitrophenyl)methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-[(3-nitrophenyl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-(3-nitrobenzyl)thieno[2,3-d]pyrimidin-4-one Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O3S/c1-9-10(2)22-14-13(9)15(19)17(8-16-14)7-11-4-3-5-12(6-11)18(20)21/h3-6,8H,7H2,1-2H3