N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide

Systemtic Name: N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: N,N-dimethyl-2-[3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]propyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C23H29N5O2S2 MolecularWeight: 471.63866

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=C(C=C3)S(=O)(=O)N(C)C)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCCCN2CCC3=C(C2)C=C(C=C3)S(=O)(=O)N(C)C)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5O2S2/c1-26(2)32(29,30)21-11-10-18-12-14-28(17-20(18)16-21)13-7-15-31-23-25-24-22(27(23)3)19-8-5-4-6-9-19/h4-6,8-11,16H,7,12-15,17H2,1-3H3