N-[(E)-N'-butylsulfonylcarbamimidoyl]-4-piperidin-1-yl-benzamide dihydrochloride

Systemtic Name: N-[(E)-N'-butylsulfonylcarbamimidoyl]-4-piperidin-1-yl-benzamide dihydrochloride Openeye Name: N-[(E)-N'-butylsulfonylcarbamimidoyl]-4-(1-piperidyl)benzamide dihydrochloride CAS Name: N-[(E)-amino(butylsulfonylimino)methyl]-4-(1-piperidinyl)benzamide dihydrochloride IUPAC Name: N-[(E)-N'-butylsulfonylcarbamimidoyl]-4-piperidin-1-ylbenzamide dihydrochloride Traditional Name: N-[(E)-N'-butylsulfonylamidino]-4-piperidino-benzamide dihydrochloride Formula: C17H28Cl2N4O3S MolecularWeight: 439.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N=C(N)NC(=O)C1=CC=C(C=C1)N2CCCCC2.Cl.Cl

Isomeric SMILES

CCCCS(=O)(=O)/N=C(\N)/NC(=O)C1=CC=C(C=C1)N2CCCCC2.Cl.Cl

InChI

InChI=1S/C17H26N4O3S.2ClH/c1-2-3-13-25(23,24)20-17(18)19-16(22)14-7-9-15(10-8-14)21-11-5-4-6-12-21;;/h7-10H,2-6,11-13H2,1H3,(H3,18,19,20,22);2*1H