5-oxidanylidene-4-phenyl-2-(2-pyrrolidin-1-ylethylsulfanyl)-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-oxidanylidene-4-phenyl-2-(2-pyrrolidin-1-ylethylsulfanyl)-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile Openeye Name: 5-oxo-4-phenyl-2-(2-pyrrolidin-1-ylethylsulfanyl)-4-(2-thienyl)-1H-pyrrole-3-carbonitrile CAS Name: 5-oxo-4-phenyl-2-[2-(1-pyrrolidinyl)ethylthio]-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile IUPAC Name: 5-oxo-4-phenyl-2-(2-pyrrolidin-1-ylethylsulfanyl)-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile Traditional Name: 5-keto-4-phenyl-2-(2-pyrrolidinoethylthio)-4-(2-thienyl)-2-pyrroline-3-carbonitrile Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CS4)C#N

Isomeric SMILES

C1CCN(C1)CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CS4)C#N

InChI

InChI=1S/C21H21N3OS2/c22-15-17-19(27-14-12-24-10-4-5-11-24)23-20(25)21(17,18-9-6-13-26-18)16-7-2-1-3-8-16/h1-3,6-9,13H,4-5,10-12,14H2,(H,23,25)