2,2-dimethyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 2,2-dimethyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 2,2-dimethyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 2,2-dimethyl-N-[6-(methylthio)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]propanamide IUPAC Name: 2,2-dimethyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 2,2-dimethyl-N-[6-(methylthio)-3-propargyl-1,3-benzothiazol-2-ylidene]propionamide Formula: C16H18N2OS2 MolecularWeight: 318.45692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC#C

Isomeric SMILES

CC(C)(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC#C

InChI

InChI=1S/C16H18N2OS2/c1-6-9-18-12-8-7-11(20-5)10-13(12)21-15(18)17-14(19)16(2,3)4/h1,7-8,10H,9H2,2-5H3