7-[[4-[1-azanyl-2-(4-methoxyphenyl)-2-methyl-piperidin-4-yl]oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide

Systemtic Name: 7-[[4-[1-azanyl-2-(4-methoxyphenyl)-2-methyl-piperidin-4-yl]oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 7-[[4-[[1-amino-2-(4-methoxyphenyl)-2-methyl-4-piperidyl]oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 7-[[4-[[1-amino-2-(4-methoxyphenyl)-2-methyl-4-piperidinyl]oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 7-[[4-[1-amino-2-(4-methoxyphenyl)-2-methylpiperidin-4-yl]oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 7-[[4-[[1-amino-2-(4-methoxyphenyl)-2-methyl-4-piperidyl]oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C29H36N6O4S MolecularWeight: 564.69894

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCN1N)OC2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(CCN(C4)C(=N)N)C=C3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1(CC(CCN1N)OC2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(CCN(C4)C(=N)N)C=C3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H36N6O4S/c1-29(22-4-7-24(38-2)8-5-22)18-26(14-16-35(29)32)39-25-9-11-27(12-10-25)40(36,37)33-23-6-3-20-13-15-34(28(30)31)19-21(20)17-23/h3-12,17,26,33H,13-16,18-19,32H2,1-2H3,(H3,30,31)