6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile

Systemtic Name: 6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-2-oxidanylidene-5-[(Z)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Openeye Name: 5-[(Z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 6-(4-ethyl-1-piperazinyl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-3-pyridinecarbonitrile IUPAC Name: 6-(4-ethylpiperazin-1-yl)-1,4-dimethyl-2-oxo-5-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyridine-3-carbonitrile Traditional Name: 5-[(Z)-(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-(4-ethylpiperazino)-2-keto-1,4-dimethyl-nicotinonitrile Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=C(C(=O)N2C)C#N)C)C=C3C(=O)N(C(=S)S3)CC=C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=C(C(=O)N2C)C#N)C)/C=C\3/C(=O)N(C(=S)S3)CC=C

InChI

InChI=1S/C21H25N5O2S2/c1-5-7-26-20(28)17(30-21(26)29)12-15-14(3)16(13-22)19(27)23(4)18(15)25-10-8-24(6-2)9-11-25/h5,12H,1,6-11H2,2-4H3/b17-12-