4-(4-chlorophenyl)-2-(2-diethylaminoethylsulfanyl)-4-(4-dimethylaminophenyl)-5-oxidanylidene-1H-pyrrole-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-(2-diethylaminoethylsulfanyl)-4-(4-dimethylaminophenyl)-5-oxidanylidene-1H-pyrrole-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-(2-diethylaminoethylsulfanyl)-4-(4-dimethylaminophenyl)-5-oxo-1H-pyrrole-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-(2-diethylaminoethylthio)-4-(4-dimethylaminophenyl)-5-oxo-1H-pyrrole-3-carbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-(2-diethylaminoethylsulfanyl)-4-(4-dimethylaminophenyl)-5-oxo-1H-pyrrole-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-(2-diethylaminoethylthio)-4-(4-dimethylaminophenyl)-5-keto-2-pyrroline-3-carbonitrile Formula: C25H29ClN4OS MolecularWeight: 469.04196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=C(C(C(=O)N1)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCN(CC)CCSC1=C(C(C(=O)N1)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C25H29ClN4OS/c1-5-30(6-2)15-16-32-23-22(17-27)25(24(31)28-23,18-7-11-20(26)12-8-18)19-9-13-21(14-10-19)29(3)4/h7-14H,5-6,15-16H2,1-4H3,(H,28,31)