N-(1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-(p-tolylsulfonyl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfonyl-N-(phenylmethyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-3-tosyl-propionamide Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H22N2O3S2/c1-18-11-13-20(14-12-18)31(28,29)16-15-23(27)26(17-19-7-3-2-4-8-19)24-25-21-9-5-6-10-22(21)30-24/h2-14H,15-17H2,1H3