N-(3,4-dioctoxyphenyl)-N-(5-sulfanylidene-1,2,4-dithiazol-3-yl)ethanamide

Systemtic Name: N-(3,4-dioctoxyphenyl)-N-(5-sulfanylidene-1,2,4-dithiazol-3-yl)ethanamide Openeye Name: N-(3,4-dioctoxyphenyl)-N-(5-thioxo-1,2,4-dithiazol-3-yl)acetamide CAS Name: N-(3,4-dioctoxyphenyl)-N-(5-sulfanylidene-1,2,4-dithiazol-3-yl)acetamide IUPAC Name: N-(3,4-dioctoxyphenyl)-N-(5-sulfanylidene-1,2,4-dithiazol-3-yl)acetamide Traditional Name: N-(3,4-dioctoxyphenyl)-N-(5-thioxo-1,2,4-dithiazol-3-yl)acetamide Formula: C26H40N2O3S3 MolecularWeight: 524.8024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)N(C2=NC(=S)SS2)C(=O)C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)N(C2=NC(=S)SS2)C(=O)C)OCCCCCCCC

InChI

InChI=1S/C26H40N2O3S3/c1-4-6-8-10-12-14-18-30-23-17-16-22(28(21(3)29)25-27-26(32)34-33-25)20-24(23)31-19-15-13-11-9-7-5-2/h16-17,20H,4-15,18-19H2,1-3H3