5-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-5,6-dihydro-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-5,6-dihydro-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 5-(3-nitrophenyl)-3-phenyl-2-thioxo-5,6-dihydro-4H-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 5-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-5,6-dihydro-4H-thiazolo[4,5-d]pyrimidin-7-one IUPAC Name: 5-(3-nitrophenyl)-3-phenyl-2-sulfanylidene-5,6-dihydro-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-(3-nitrophenyl)-3-phenyl-2-thioxo-5,6-dihydro-4H-thiazolo[4,5-d]pyrimidin-7-one Formula: C17H12N4O3S2 MolecularWeight: 384.43218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C(=O)NC(N3)C4=CC(=CC=C4)[N+](=O)[O-])SC2=S

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C(=O)NC(N3)C4=CC(=CC=C4)[N+](=O)[O-])SC2=S

InChI

InChI=1S/C17H12N4O3S2/c22-16-13-15(20(17(25)26-13)11-6-2-1-3-7-11)18-14(19-16)10-5-4-8-12(9-10)21(23)24/h1-9,14,18H,(H,19,22)