N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-3-[2-[(6-phenylmethoxynaphthalen-2-yl)sulfonylamino]-1H-indol-3-yl]propanamide hydrochloride

Systemtic Name: N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-3-[2-[(6-phenylmethoxynaphthalen-2-yl)sulfonylamino]-1H-indol-3-yl]propanamide hydrochloride Openeye Name: 3-[2-[(6-benzyloxy-2-naphthyl)sulfonylamino]-1H-indol-3-yl]-N-(1-carbamimidoyl-3-piperidyl)-N-methyl-propanamide hydrochloride CAS Name: N-(1-carbamimidoyl-3-piperidinyl)-N-methyl-3-[2-[(6-phenylmethoxy-2-naphthalenyl)sulfonylamino]-1H-indol-3-yl]propanamide hydrochloride IUPAC Name: N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-3-[2-[(6-phenylmethoxynaphthalen-2-yl)sulfonylamino]-1H-indol-3-yl]propanamide hydrochloride Traditional Name: N-(1-amidino-3-piperidyl)-3-[2-[(6-benzoxy-2-naphthyl)sulfonylamino]-1H-indol-3-yl]-N-methyl-propionamide hydrochloride Formula: C35H39ClN6O4S MolecularWeight: 675.23996

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCN(C1)C(=N)N)C(=O)CCC2=C(NC3=CC=CC=C32)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)OCC6=CC=CC=C6.Cl

Isomeric SMILES

CN(C1CCCN(C1)C(=N)N)C(=O)CCC2=C(NC3=CC=CC=C32)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)OCC6=CC=CC=C6.Cl

InChI

InChI=1S/C35H38N6O4S.ClH/c1-40(27-10-7-19-41(22-27)35(36)37)33(42)18-17-31-30-11-5-6-12-32(30)38-34(31)39-46(43,44)29-16-14-25-20-28(15-13-26(25)21-29)45-23-24-8-3-2-4-9-24;/h2-6,8-9,11-16,20-21,27,38-39H,7,10,17-19,22-23H2,1H3,(H3,36,37);1H