1-(3-nitrophenyl)-3-prop-2-ynyl-2-sulfanylidene-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 1-(3-nitrophenyl)-3-prop-2-ynyl-2-sulfanylidene-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 1-(3-nitrophenyl)-3-prop-2-ynyl-2-thioxo-pyrido[2,3-d]pyrimidin-4-one CAS Name: 1-(3-nitrophenyl)-3-prop-2-ynyl-2-sulfanylidene-4-pyrido[2,3-d]pyrimidinone IUPAC Name: 1-(3-nitrophenyl)-3-prop-2-ynyl-2-sulfanylidenepyrido[2,3-d]pyrimidin-4-one Traditional Name: 1-(3-nitrophenyl)-3-propargyl-2-thioxo-pyrido[2,3-d]pyrimidin-4-one Formula: C16H10N4O3S MolecularWeight: 338.3406

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C2=C(N=CC=C2)N(C1=S)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C#CCN1C(=O)C2=C(N=CC=C2)N(C1=S)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O3S/c1-2-9-18-15(21)13-7-4-8-17-14(13)19(16(18)24)11-5-3-6-12(10-11)20(22)23/h1,3-8,10H,9H2