N-methyl-4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]aniline

Systemtic Name: N-methyl-4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]aniline Openeye Name: N-methyl-4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]aniline CAS Name: N-methyl-4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]aniline IUPAC Name: N-methyl-4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]aniline Traditional Name: methyl-[4-[(4-phenethyl-1,4-diazepan-1-yl)sulfonyl]phenyl]amine Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CNC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O2S/c1-21-19-8-10-20(11-9-19)26(24,25)23-14-5-13-22(16-17-23)15-12-18-6-3-2-4-7-18/h2-4,6-11,21H,5,12-17H2,1H3