1-ethyl-2-[3-(oxidanylidenemethylidene)pyrrolidin-2-yl]-3-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]indole-6-carbonitrile

Systemtic Name: 1-ethyl-2-[3-(oxidanylidenemethylidene)pyrrolidin-2-yl]-3-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]indole-6-carbonitrile Openeye Name: 1-ethyl-2-[3-(oxomethylene)pyrrolidin-2-yl]-3-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]indole-6-carbonitrile CAS Name: 1-ethyl-3-[1-(3-mercapto-1-oxopropyl)-2-pyrrolidinyl]-2-[3-(oxomethylidene)-2-pyrrolidinyl]-6-indolecarbonitrile IUPAC Name: 1-ethyl-2-[3-(oxomethylidene)pyrrolidin-2-yl]-3-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]indole-6-carbonitrile Traditional Name: 1-ethyl-2-[3-(ketomethylene)pyrrolidin-2-yl]-3-[1-(3-mercaptopropanoyl)pyrrolidin-2-yl]indole-6-carbonitrile Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C#N)C(=C1C3C(=C=O)CCN3)C4CCCN4C(=O)CCS

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C#N)C(=C1C3C(=C=O)CCN3)C4CCCN4C(=O)CCS

InChI

InChI=1S/C23H26N4O2S/c1-2-26-19-12-15(13-24)5-6-17(19)21(23(26)22-16(14-28)7-9-25-22)18-4-3-10-27(18)20(29)8-11-30/h5-6,12,18,22,25,30H,2-4,7-11H2,1H3