N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonyl-butanamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(p-tolylsulfonyl)butanamide CAS Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonylbutanamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methylphenyl)sulfonylbutanamide Traditional Name: N-(2-diethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-tosyl-butyramide Formula: C26H35N3O3S2 MolecularWeight: 501.7044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(CC)CC)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(CC)CC)C(=O)CCCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H35N3O3S2/c1-5-21-10-8-11-23-25(21)27-26(33-23)29(18-17-28(6-2)7-3)24(30)12-9-19-34(31,32)22-15-13-20(4)14-16-22/h8,10-11,13-16H,5-7,9,12,17-19H2,1-4H3