N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]propane-1-sulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]propane-1-sulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]propane-1-sulfonamide CAS Name: N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)thio]-1-propanesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)sulfanyl]propane-1-sulfonamide Traditional Name: N-(4-methoxyphenyl)-3-[(5-methyl-1,3-benzothiazol-2-yl)thio]propane-1-sulfonamide Formula: C18H20N2O3S3 MolecularWeight: 408.558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)SCCCS(=O)(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)SCCCS(=O)(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H20N2O3S3/c1-13-4-9-17-16(12-13)19-18(25-17)24-10-3-11-26(21,22)20-14-5-7-15(23-2)8-6-14/h4-9,12,20H,3,10-11H2,1-2H3