N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylpropyl)propanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylpropyl)propanamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-[3-(4-morpholinyl)propyl]propanamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(3-morpholin-4-ylpropyl)propanamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)-3-tosyl-propionamide Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)C

InChI

InChI=1S/C25H31N3O4S2/c1-19-7-9-21(10-8-19)34(30,31)18-11-23(29)28(13-4-12-27-14-16-32-17-15-27)25-26-24-20(2)5-3-6-22(24)33-25/h3,5-10H,4,11-18H2,1-2H3