2-(6-methyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-(6-methyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)ethanamide Openeye Name: 2-(3-allyl-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)acetamide CAS Name: 2-[(6-methyl-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(6-methyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(3-allyl-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(3-nitrophenyl)acetamide Formula: C18H16N4O4S2 MolecularWeight: 416.47404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S2/c1-3-7-21-17(24)14-8-11(2)28-16(14)20-18(21)27-10-15(23)19-12-5-4-6-13(9-12)22(25)26/h3-6,8-9H,1,7,10H2,2H3,(H,19,23)