2-ethylsulfonyl-N'-(4-methylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide

Systemtic Name: 2-ethylsulfonyl-N'-(4-methylphenyl)carbonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Openeye Name: 2-ethylsulfonyl-N'-(4-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carbohydrazide CAS Name: 2-ethylsulfonyl-N'-[(4-methylphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carbohydrazide IUPAC Name: 2-ethylsulfonyl-N'-(4-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Traditional Name: 2-esyl-N'-p-toluoyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NNC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NNC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H23N3O4S/c1-3-28(26,27)23-13-17-7-5-4-6-16(17)12-18(23)20(25)22-21-19(24)15-10-8-14(2)9-11-15/h4-11,18H,3,12-13H2,1-2H3,(H,21,24)(H,22,25)