(3-oxidanylidene-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxymethanethioic S-acid

Systemtic Name: (3-oxidanylidene-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxymethanethioic S-acid Openeye Name: (3-oxo-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxymethanethioic S-acid CAS Name: (3-oxo-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxymethanethioic S-acid IUPAC Name: (3-oxo-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxymethanethioic S-acid Traditional Name: (3-keto-6-phenyl-2,5-dihydro-1H-pyrido[1,2-a]benzimidazol-4-yl)oxythioformic acid Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C3=CC=CC(=C3NC2=C(C1=O)OC(=O)S)C4=CC=CC=C4

Isomeric SMILES

C1CN2C3=CC=CC(=C3NC2=C(C1=O)OC(=O)S)C4=CC=CC=C4

InChI

InChI=1S/C18H14N2O3S/c21-14-9-10-20-13-8-4-7-12(11-5-2-1-3-6-11)15(13)19-17(20)16(14)23-18(22)24/h1-8,19H,9-10H2,(H,22,24)