N-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-N-(phenylmethyl)propan-1-amine hydrochloride

Systemtic Name: N-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-N-(phenylmethyl)propan-1-amine hydrochloride Openeye Name: N-benzyl-N-[[5-(5-ethylsulfonyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]propan-1-amine hydrochloride CAS Name: N-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]-N-(phenylmethyl)-1-propanamine hydrochloride IUPAC Name: N-benzyl-N-[[5-(5-ethylsulfonyl-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]propan-1-amine hydrochloride Traditional Name: benzyl-[[5-(5-esyl-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]-propyl-amine hydrochloride Formula: C24H31ClN2O3S MolecularWeight: 463.03254

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)CC2=CC=C(N2)C3=C(C=CC(=C3)S(=O)(=O)CC)OC.Cl

Isomeric SMILES

CCCN(CC1=CC=CC=C1)CC2=CC=C(N2)C3=C(C=CC(=C3)S(=O)(=O)CC)OC.Cl

InChI

InChI=1S/C24H30N2O3S.ClH/c1-4-15-26(17-19-9-7-6-8-10-19)18-20-11-13-23(25-20)22-16-21(30(27,28)5-2)12-14-24(22)29-3;/h6-14,16,25H,4-5,15,17-18H2,1-3H3;1H