2-[4-(3-methylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamine

Systemtic Name: 2-[4-(3-methylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamine Openeye Name: 2-[4-(m-tolylsulfonyl)-1,4-diazepan-1-yl]ethanamine CAS Name: 2-[4-(3-methylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamine IUPAC Name: 2-[4-(3-methylphenyl)sulfonyl-1,4-diazepan-1-yl]ethanamine Traditional Name: 2-[4-(m-tolylsulfonyl)-1,4-diazepan-1-yl]ethylamine Formula: C14H23N3O2S MolecularWeight: 297.41632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCCN(CC2)CCN

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCCN(CC2)CCN

InChI

InChI=1S/C14H23N3O2S/c1-13-4-2-5-14(12-13)20(18,19)17-8-3-7-16(9-6-15)10-11-17/h2,4-5,12H,3,6-11,15H2,1H3