1-[[4-(1-carbamimidoylpiperidin-4-yl)oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide

Systemtic Name: 1-[[4-(1-carbamimidoylpiperidin-4-yl)oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 1-[[4-[(1-carbamimidoyl-4-piperidyl)oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 1-[[4-[(1-carbamimidoyl-4-piperidinyl)oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 1-[[4-(1-carbamimidoylpiperidin-4-yl)oxyphenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 1-[[4-[(1-amidino-4-piperidyl)oxy]phenyl]sulfonylamino]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C22H29N7O3S MolecularWeight: 471.57576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=C(C=C2)S(=O)(=O)NC3C4=CC=CC=C4CCN3C(=N)N)C(=N)N

Isomeric SMILES

C1CN(CCC1OC2=CC=C(C=C2)S(=O)(=O)NC3C4=CC=CC=C4CCN3C(=N)N)C(=N)N

InChI

InChI=1S/C22H29N7O3S/c23-21(24)28-12-10-17(11-13-28)32-16-5-7-18(8-6-16)33(30,31)27-20-19-4-2-1-3-15(19)9-14-29(20)22(25)26/h1-8,17,20,27H,9-14H2,(H3,23,24)(H3,25,26)