4-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(ethylthio)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-ethylsulfanyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(ethylthio)-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C17H16N2O3S3 MolecularWeight: 392.51554

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H16N2O3S3/c1-3-23-12-6-4-11(5-7-12)16(20)19-17-18-14-9-8-13(25(2,21)22)10-15(14)24-17/h4-10H,3H2,1-2H3,(H,18,19,20)