2-(2-diethylaminoethylsulfanyl)-4,4-bis(4-methoxyphenyl)-5-oxidanylidene-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-(2-diethylaminoethylsulfanyl)-4,4-bis(4-methoxyphenyl)-5-oxidanylidene-1H-pyrrole-3-carbonitrile Openeye Name: 2-(2-diethylaminoethylsulfanyl)-4,4-bis(4-methoxyphenyl)-5-oxo-1H-pyrrole-3-carbonitrile CAS Name: 2-(2-diethylaminoethylthio)-4,4-bis(4-methoxyphenyl)-5-oxo-1H-pyrrole-3-carbonitrile IUPAC Name: 2-(2-diethylaminoethylsulfanyl)-4,4-bis(4-methoxyphenyl)-5-oxo-1H-pyrrole-3-carbonitrile Traditional Name: 2-(2-diethylaminoethylthio)-5-keto-4,4-bis(4-methoxyphenyl)-2-pyrroline-3-carbonitrile Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O3S/c1-5-28(6-2)15-16-32-23-22(17-26)25(24(29)27-23,18-7-11-20(30-3)12-8-18)19-9-13-21(31-4)14-10-19/h7-14H,5-6,15-16H2,1-4H3,(H,27,29)