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

Systemtic Name: 6-methyl-2-[(4-nitrophenyl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-2-[(4-nitrophenyl)methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-2-[(4-nitrophenyl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-2-[(4-nitrophenyl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-2-(4-nitrobenzyl)-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H13N3O3S2 MolecularWeight: 383.44412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C18H13N3O3S2/c1-10-15(13-3-2-8-25-13)16-17(22)19-14(20-18(16)26-10)9-11-4-6-12(7-5-11)21(23)24/h2-8H,9H2,1H3,(H,19,20,22)