6-(2-methylprop-2-enoylamino)-N-(2-sulfanylidene-3H-1,3-benzothiazol-4-yl)hexanamide

Systemtic Name: 6-(2-methylprop-2-enoylamino)-N-(2-sulfanylidene-3H-1,3-benzothiazol-4-yl)hexanamide Openeye Name: 6-(2-methylprop-2-enoylamino)-N-(2-thioxo-3H-1,3-benzothiazol-4-yl)hexanamide CAS Name: 6-[(2-methyl-1-oxoprop-2-enyl)amino]-N-(2-sulfanylidene-3H-1,3-benzothiazol-4-yl)hexanamide IUPAC Name: 6-(2-methylprop-2-enoylamino)-N-(2-sulfanylidene-3H-1,3-benzothiazol-4-yl)hexanamide Traditional Name: 6-methacrylamido-N-(2-thioxo-3H-1,3-benzothiazol-4-yl)hexanamide Formula: C17H21N3O2S2 MolecularWeight: 363.49754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NCCCCCC(=O)NC1=C2C(=CC=C1)SC(=S)N2

Isomeric SMILES

CC(=C)C(=O)NCCCCCC(=O)NC1=C2C(=CC=C1)SC(=S)N2

InChI

InChI=1S/C17H21N3O2S2/c1-11(2)16(22)18-10-5-3-4-9-14(21)19-12-7-6-8-13-15(12)20-17(23)24-13/h6-8H,1,3-5,9-10H2,2H3,(H,18,22)(H,19,21)(H,20,23)