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

Systemtic Name: 2-[2-[(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfonyl-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[2-[(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl]sulfonyl-N-thiazol-2-yl-acetamide CAS Name: 2-[2-[(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-N-(2-thiazolyl)acetamide IUPAC Name: 2-[2-[(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfonyl-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[2-keto-2-[(6-methyl-3-propargyl-1,3-benzothiazol-2-ylidene)amino]ethyl]sulfonyl-N-thiazol-2-yl-acetamide Formula: C18H16N4O4S3 MolecularWeight: 448.53904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)NC3=NC=CS3)S2)CC#C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)NC3=NC=CS3)S2)CC#C

InChI

InChI=1S/C18H16N4O4S3/c1-3-7-22-13-5-4-12(2)9-14(13)28-18(22)21-16(24)11-29(25,26)10-15(23)20-17-19-6-8-27-17/h1,4-6,8-9H,7,10-11H2,2H3,(H,19,20,23)