N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(p-tolylsulfonylamino)propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-3-(tosylamino)propionamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H21N3O3S2/c1-14-7-9-15(10-8-14)27(24,25)20-12-11-19(23)22(2)13-18-21-16-5-3-4-6-17(16)26-18/h3-10,20H,11-13H2,1-2H3