N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide

Systemtic Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide Openeye Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide CAS Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonylbenzamide IUPAC Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonylbenzamide Traditional Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-mesyl-benzamide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)N2CC

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)N2CC

InChI

InChI=1S/C19H20N2O3S2/c1-4-13-8-7-11-16-17(13)21(5-2)19(25-16)20-18(22)14-9-6-10-15(12-14)26(3,23)24/h6-12H,4-5H2,1-3H3