(pyridin-3-ylmethylamino)-(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methanolate

Systemtic Name: (pyridin-3-ylmethylamino)-(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methanolate Openeye Name: (3-pyridylmethylamino)-(6-thioxocyclohexa-2,4-dien-1-ylidene)methanolate CAS Name: (3-pyridinylmethylamino)-(6-sulfanylidene-1-cyclohexa-2,4-dienylidene)methanolate IUPAC Name: (pyridin-3-ylmethylamino)-(6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)methanolate Traditional Name: (3-pyridylmethylamino)-(6-thioxocyclohexa-2,4-dien-1-ylidene)methanolate Formula: C13H11N2OS- MolecularWeight: 243.30424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(NCC2=CN=CC=C2)[O-])C(=S)C=C1

Isomeric SMILES

C1=CC(=C(NCC2=CN=CC=C2)[O-])C(=S)C=C1

InChI

InChI=1S/C13H12N2OS/c16-13(11-5-1-2-6-12(11)17)15-9-10-4-3-7-14-8-10/h1-8,15-16H,9H2/p-1