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

Systemtic Name: 5,6-dimethyl-2-(2-nitrophenyl)sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5,6-dimethyl-2-(2-nitrophenyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(2-nitrophenyl)thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-(2-nitrophenyl)sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5,6-dimethyl-2-[(2-nitrophenyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C17H15N3O3S2 MolecularWeight: 373.4493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC3=CC=CC=C3[N+](=O)[O-])CC=C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC3=CC=CC=C3[N+](=O)[O-])CC=C)C

InChI

InChI=1S/C17H15N3O3S2/c1-4-9-19-16(21)14-10(2)11(3)24-15(14)18-17(19)25-13-8-6-5-7-12(13)20(22)23/h4-8H,1,9H2,2-3H3