N-(4-methyl-1,3-thiazol-2-yl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-methylthiazol-2-yl)-2-[4-(6-thioxoheptanoyl)piperazin-1-yl]acetamide CAS Name: N-(4-methyl-2-thiazolyl)-2-[4-(1-oxo-6-sulfanylideneheptyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]acetamide Traditional Name: N-(4-methylthiazol-2-yl)-2-[4-(6-thioxoheptanoyl)piperazino]acetamide Formula: C17H26N4O2S2 MolecularWeight: 382.54394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN2CCN(CC2)C(=O)CCCCC(=S)C

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN2CCN(CC2)C(=O)CCCCC(=S)C

InChI

InChI=1S/C17H26N4O2S2/c1-13-12-25-17(18-13)19-15(22)11-20-7-9-21(10-8-20)16(23)6-4-3-5-14(2)24/h12H,3-11H2,1-2H3,(H,18,19,22)