3-[4-(azepan-1-yl)-4-oxidanylidene-butyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-[4-(azepan-1-yl)-4-oxidanylidene-butyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-[4-(azepan-1-yl)-4-oxo-butyl]-5-(p-tolylmethylene)-2-thioxo-thiazolidin-4-one CAS Name: 3-[4-(1-azepanyl)-4-oxobutyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-[4-(azepan-1-yl)-4-oxobutyl]-5-[(4-methylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-[4-(azepan-1-yl)-4-keto-butyl]-5-(4-methylbenzylidene)-2-thioxo-thiazolidin-4-one Formula: C21H26N2O2S2 MolecularWeight: 402.57334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O2S2/c1-16-8-10-17(11-9-16)15-18-20(25)23(21(26)27-18)14-6-7-19(24)22-12-4-2-3-5-13-22/h8-11,15H,2-7,12-14H2,1H3