N'-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-N,N-dimethyl-methanimidamide hydrochloride

Systemtic Name: N'-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-N,N-dimethyl-methanimidamide hydrochloride Openeye Name: N'-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-N,N-dimethyl-formamidine hydrochloride CAS Name: N'-[3-(1-azepanylsulfonyl)-4-methylphenyl]-N,N-dimethylmethanimidamide hydrochloride IUPAC Name: N'-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-N,N-dimethylmethanimidamide hydrochloride Traditional Name: N'-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-N,N-dimethyl-formamidine hydrochloride Formula: C16H26ClN3O2S MolecularWeight: 359.91454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=CN(C)C)S(=O)(=O)N2CCCCCC2.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N=CN(C)C)S(=O)(=O)N2CCCCCC2.Cl

InChI

InChI=1S/C16H25N3O2S.ClH/c1-14-8-9-15(17-13-18(2)3)12-16(14)22(20,21)19-10-6-4-5-7-11-19;/h8-9,12-13H,4-7,10-11H2,1-3H3;1H