5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-chloranyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-chloranyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-chloro-isothiazole-4-carbonitrile CAS Name: 5-[4-(1-azepanylsulfonyl)-1-piperazinyl]-3-chloro-4-isothiazolecarbonitrile IUPAC Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-chloro-1,2-thiazole-4-carbonitrile Traditional Name: 5-[4-(azepan-1-ylsulfonyl)piperazino]-3-chloro-isothiazole-4-carbonitrile Formula: C14H20ClN5O2S2 MolecularWeight: 389.9239

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C3=C(C(=NS3)Cl)C#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C14H20ClN5O2S2/c15-13-12(11-16)14(23-17-13)18-7-9-20(10-8-18)24(21,22)19-5-3-1-2-4-6-19/h1-10H2