2-[2-[(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[2-[(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[2-[(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl]sulfonyl-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[2-[(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[2-[(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[2-[(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)amino]-2-keto-ethyl]sulfonyl-N-(5-methylisoxazol-3-yl)acetamide Formula: C18H15BrN4O5S2 MolecularWeight: 511.3695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CS(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CS(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

InChI

InChI=1S/C18H15BrN4O5S2/c1-3-6-23-13-5-4-12(19)8-14(13)29-18(23)21-17(25)10-30(26,27)9-16(24)20-15-7-11(2)28-22-15/h1,4-5,7-8H,6,9-10H2,2H3,(H,20,22,24)