(3R)-2-[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-[[3-(cyclopropylsulfamoyl)-4-methoxyphenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)N)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)N)S(=O)(=O)NC4CC4

InChI

InChI=1S/C21H23N3O5S/c1-29-18-9-6-14(11-19(18)30(27,28)23-16-7-8-16)21(26)24-12-15-5-3-2-4-13(15)10-17(24)20(22)25/h2-6,9,11,16-17,23H,7-8,10,12H2,1H3,(H2,22,25)/t17-/m1/s1