4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-2-methylsulfanyl-5-oxidanylidene-4-pyridin-3-yl-pyrrole-3-carbonitrile

Systemtic Name: 4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-2-methylsulfanyl-5-oxidanylidene-4-pyridin-3-yl-pyrrole-3-carbonitrile Openeye Name: 4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-2-methylsulfanyl-5-oxo-4-(3-pyridyl)pyrrole-3-carbonitrile CAS Name: 4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-2-(methylthio)-5-oxo-4-(3-pyridinyl)-3-pyrrolecarbonitrile IUPAC Name: 4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-2-methylsulfanyl-5-oxo-4-pyridin-3-ylpyrrole-3-carbonitrile Traditional Name: 4-(4-dimethylaminophenyl)-1-[3-(dimethylamino)propyl]-5-keto-2-(methylthio)-4-(3-pyridyl)-2-pyrroline-3-carbonitrile Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=C(C(C1=O)(C2=CC=C(C=C2)N(C)C)C3=CN=CC=C3)C#N)SC

Isomeric SMILES

CN(C)CCCN1C(=C(C(C1=O)(C2=CC=C(C=C2)N(C)C)C3=CN=CC=C3)C#N)SC

InChI

InChI=1S/C24H29N5OS/c1-27(2)14-7-15-29-22(31-5)21(16-25)24(23(29)30,19-8-6-13-26-17-19)18-9-11-20(12-10-18)28(3)4/h6,8-13,17H,7,14-15H2,1-5H3