(2E)-3-(azepan-1-yl)-3-oxidanylidene-2-(4-oxidanylidene-3-phenyl-1,3-thiazolidin-2-ylidene)propanenitrile

Systemtic Name: (2E)-3-(azepan-1-yl)-3-oxidanylidene-2-(4-oxidanylidene-3-phenyl-1,3-thiazolidin-2-ylidene)propanenitrile Openeye Name: (2E)-3-(azepan-1-yl)-3-oxo-2-(4-oxo-3-phenyl-thiazolidin-2-ylidene)propanenitrile CAS Name: (2E)-3-(1-azepanyl)-3-oxo-2-(4-oxo-3-phenyl-2-thiazolidinylidene)propanenitrile IUPAC Name: (2E)-3-(azepan-1-yl)-3-oxo-2-(4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)propanenitrile Traditional Name: (2E)-3-(azepan-1-yl)-3-keto-2-(4-keto-3-phenyl-thiazolidin-2-ylidene)propionitrile Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=C2N(C(=O)CS2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=C/2\N(C(=O)CS2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C18H19N3O2S/c19-12-15(17(23)20-10-6-1-2-7-11-20)18-21(16(22)13-24-18)14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-11,13H2/b18-15+