5-[(Z)-[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxidanylidene-6-[4-(phenylmethyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 5-[(Z)-[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxidanylidene-6-[4-(phenylmethyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-(4-benzylpiperazin-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-1,4-dimethyl-2-oxo-6-[4-(phenylmethyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-(4-benzylpiperazin-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile Traditional Name: 6-(4-benzylpiperazino)-5-[(Z)-[3-(3-ethoxypropyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]methyl]-2-keto-1,4-dimethyl-nicotinonitrile Formula: C28H33N5O3S2 MolecularWeight: 551.72332

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)CC4=CC=CC=C4)SC1=S

Isomeric SMILES

CCOCCCN1C(=O)/C(=C/C2=C(N(C(=O)C(=C2C)C#N)C)N3CCN(CC3)CC4=CC=CC=C4)/SC1=S

InChI

InChI=1S/C28H33N5O3S2/c1-4-36-16-8-11-33-27(35)24(38-28(33)37)17-22-20(2)23(18-29)26(34)30(3)25(22)32-14-12-31(13-15-32)19-21-9-6-5-7-10-21/h5-7,9-10,17H,4,8,11-16,19H2,1-3H3/b24-17-