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2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)ethanamide

2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)ethanamide

Systemtic Name:2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)ethanamide
Openeye Name:2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide
CAS Name:2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide
IUPAC Name:2-(4-ethylphenyl)-N-(6-methylsulfonyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide
Traditional Name:2-(4-ethylphenyl)-N-(6-mesyl-3-propargyl-1,3-benzothiazol-2-ylidene)acetamide
Formula: C21H20N2O3S2
MolecularWeight: 412.5251
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC#C


Isomeric SMILES

CCC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC#C


InChI

InChI=1S/C21H20N2O3S2/c1-4-12-23-18-11-10-17(28(3,25)26)14-19(18)27-21(23)22-20(24)13-16-8-6-15(5-2)7-9-16/h1,6-11,14H,5,12-13H2,2-3H3


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