7-[cyclopropyl-[4-[1-(cyclopropyliminomethyl)piperidin-4-yl]oxyphenyl]sulfonyl-amino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide

Systemtic Name: 7-[cyclopropyl-[4-[1-(cyclopropyliminomethyl)piperidin-4-yl]oxyphenyl]sulfonyl-amino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 7-[cyclopropyl-[4-[[1-(cyclopropyliminomethyl)-4-piperidyl]oxy]phenyl]sulfonyl-amino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 7-[cyclopropyl-[4-[[1-(cyclopropyliminomethyl)-4-piperidinyl]oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 7-[cyclopropyl-[4-[1-(cyclopropyliminomethyl)piperidin-4-yl]oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 7-[cyclopropyl-[4-[[1-(cyclopropyliminomethyl)-4-piperidyl]oxy]phenyl]sulfonyl-amino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C28H36N6O3S MolecularWeight: 536.68884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N=CN2CCC(CC2)OC3=CC=C(C=C3)S(=O)(=O)N(C4CC4)C5=CC6=C(CCN(C6)C(=N)N)C=C5

Isomeric SMILES

C1CC1N=CN2CCC(CC2)OC3=CC=C(C=C3)S(=O)(=O)N(C4CC4)C5=CC6=C(CCN(C6)C(=N)N)C=C5

InChI

InChI=1S/C28H36N6O3S/c29-28(30)33-16-11-20-1-4-24(17-21(20)18-33)34(23-5-6-23)38(35,36)27-9-7-25(8-10-27)37-26-12-14-32(15-13-26)19-31-22-2-3-22/h1,4,7-10,17,19,22-23,26H,2-3,5-6,11-16,18H2,(H3,29,30)