2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-4,6-dimethylpyridine-3-carbonitrile Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-4,6-dimethyl-nicotinonitrile Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)N2CCN(CC2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C18H27N5O2S/c1-15-13-16(2)20-18(17(15)14-19)21-9-11-23(12-10-21)26(24,25)22-7-5-3-4-6-8-22/h13H,3-12H2,1-2H3