N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-benzamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-benzamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-benzamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonylbenzamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonylbenzamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-propylsulfonyl-benzamide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=NC3=C(C=CC=C3S2)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=NC3=C(C=CC=C3S2)C

InChI

InChI=1S/C18H18N2O3S2/c1-3-11-25(22,23)15-10-5-4-8-13(15)17(21)20-18-19-16-12(2)7-6-9-14(16)24-18/h4-10H,3,11H2,1-2H3,(H,19,20,21)