[3-(1H-benzimidazol-2-yl)propylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate

Systemtic Name: [3-(1H-benzimidazol-2-yl)propylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Openeye Name: [3-(1H-benzimidazol-2-yl)propylamino]-(2-thioxo-3-pyridylidene)methanolate CAS Name: [3-(1H-benzimidazol-2-yl)propylamino]-(2-sulfanylidene-3-pyridinylidene)methanolate IUPAC Name: [3-(1H-benzimidazol-2-yl)propylamino]-(2-sulfanylidenepyridin-3-ylidene)methanolate Traditional Name: [3-(1H-benzimidazol-2-yl)propylamino]-(2-thioxo-3-pyridylidene)methanolate Formula: C16H15N4OS- MolecularWeight: 311.3815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCCNC(=C3C=CC=NC3=S)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCCNC(=C3C=CC=NC3=S)[O-]

InChI

InChI=1S/C16H16N4OS/c21-15(11-5-3-10-18-16(11)22)17-9-4-8-14-19-12-6-1-2-7-13(12)20-14/h1-3,5-7,10,17,21H,4,8-9H2,(H,19,20)/p-1