5-(4-dimethylaminophenyl)-5-oxidanyl-4-pyridin-3-yl-2-sulfanylidene-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-(4-dimethylaminophenyl)-5-oxidanyl-4-pyridin-3-yl-2-sulfanylidene-1H-pyrrole-3-carbonitrile Openeye Name: 5-(4-dimethylaminophenyl)-5-hydroxy-4-(3-pyridyl)-2-thioxo-1H-pyrrole-3-carbonitrile CAS Name: 5-(4-dimethylaminophenyl)-5-hydroxy-4-(3-pyridinyl)-2-sulfanylidene-1H-pyrrole-3-carbonitrile IUPAC Name: 5-(4-dimethylaminophenyl)-5-hydroxy-4-pyridin-3-yl-2-sulfanylidene-1H-pyrrole-3-carbonitrile Traditional Name: 5-(4-dimethylaminophenyl)-5-hydroxy-4-(3-pyridyl)-2-thioxo-3-pyrroline-3-carbonitrile Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2(C(=C(C(=S)N2)C#N)C3=CN=CC=C3)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2(C(=C(C(=S)N2)C#N)C3=CN=CC=C3)O

InChI

InChI=1S/C18H16N4OS/c1-22(2)14-7-5-13(6-8-14)18(23)16(12-4-3-9-20-11-12)15(10-19)17(24)21-18/h3-9,11,23H,1-2H3,(H,21,24)