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

Systemtic Name: 2-(2-morpholin-4-ylethylsulfanyl)-5-oxidanylidene-4-phenyl-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile Openeye Name: 2-(2-morpholinoethylsulfanyl)-5-oxo-4-phenyl-4-(2-thienyl)-1H-pyrrole-3-carbonitrile CAS Name: 2-[2-(4-morpholinyl)ethylthio]-5-oxo-4-phenyl-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile IUPAC Name: 2-(2-morpholin-4-ylethylsulfanyl)-5-oxo-4-phenyl-4-thiophen-2-yl-1H-pyrrole-3-carbonitrile Traditional Name: 5-keto-2-(2-morpholinoethylthio)-4-phenyl-4-(2-thienyl)-2-pyrroline-3-carbonitrile Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CS4)C#N

Isomeric SMILES

C1COCCN1CCSC2=C(C(C(=O)N2)(C3=CC=CC=C3)C4=CC=CS4)C#N

InChI

InChI=1S/C21H21N3O2S2/c22-15-17-19(28-14-10-24-8-11-26-12-9-24)23-20(25)21(17,18-7-4-13-27-18)16-5-2-1-3-6-16/h1-7,13H,8-12,14H2,(H,23,25)