N-(2-azanylethyl)-N-(3,4-dimethoxyphenyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(2-azanylethyl)-N-(3,4-dimethoxyphenyl)isoquinoline-5-sulfonamide Openeye Name: N-(2-aminoethyl)-N-(3,4-dimethoxyphenyl)isoquinoline-5-sulfonamide CAS Name: N-(2-aminoethyl)-N-(3,4-dimethoxyphenyl)-5-isoquinolinesulfonamide IUPAC Name: N-(2-aminoethyl)-N-(3,4-dimethoxyphenyl)isoquinoline-5-sulfonamide Traditional Name: N-(2-aminoethyl)-N-(3,4-dimethoxyphenyl)isoquinoline-5-sulfonamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CCN)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CCN)S(=O)(=O)C2=CC=CC3=C2C=CN=C3)OC

InChI

InChI=1S/C19H21N3O4S/c1-25-17-7-6-15(12-18(17)26-2)22(11-9-20)27(23,24)19-5-3-4-14-13-21-10-8-16(14)19/h3-8,10,12-13H,9,11,20H2,1-2H3