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

Systemtic Name: 5-chloranyl-3-[2-(3-methyl-4-nitroso-piperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 5-chloro-3-[2-(3-methyl-4-nitroso-piperazin-1-yl)-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 5-chloro-3-[2-(3-methyl-4-nitroso-1-piperazinyl)-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 5-chloro-3-[2-(3-methyl-4-nitrosopiperazin-1-yl)-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 5-chloro-3-[2-keto-2-(3-methyl-4-nitroso-piperazino)ethyl]-1,3-benzothiazol-2-one Formula: C14H15ClN4O3S MolecularWeight: 354.8119

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1N=O)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

Isomeric SMILES

CC1CN(CCN1N=O)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

InChI

InChI=1S/C14H15ClN4O3S/c1-9-7-17(4-5-19(9)16-22)13(20)8-18-11-6-10(15)2-3-12(11)23-14(18)21/h2-3,6,9H,4-5,7-8H2,1H3