5-chloranyl-3-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one

Systemtic Name: 5-chloranyl-3-[2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 5-chloro-3-[2-(1,4-diazepan-1-yl)-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 5-chloro-3-[2-(1,4-diazepan-1-yl)-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 5-chloro-3-[2-(1,4-diazepan-1-yl)-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 5-chloro-3-[2-(1,4-diazepan-1-yl)-2-keto-ethyl]-1,3-benzothiazol-2-one Formula: C14H16ClN3O2S MolecularWeight: 325.81374

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

Isomeric SMILES

C1CNCCN(C1)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

InChI

InChI=1S/C14H16ClN3O2S/c15-10-2-3-12-11(8-10)18(14(20)21-12)9-13(19)17-6-1-4-16-5-7-17/h2-3,8,16H,1,4-7,9H2