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

Systemtic Name: 5-methyl-3-[2-(4-nitrosopiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 5-methyl-3-[2-(4-nitrosopiperazin-1-yl)-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 5-methyl-3-[2-(4-nitroso-1-piperazinyl)-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 5-methyl-3-[2-(4-nitrosopiperazin-1-yl)-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 3-[2-keto-2-(4-nitrosopiperazino)ethyl]-5-methyl-1,3-benzothiazol-2-one Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=O)N2CC(=O)N3CCN(CC3)N=O

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=O)N2CC(=O)N3CCN(CC3)N=O

InChI

InChI=1S/C14H16N4O3S/c1-10-2-3-12-11(8-10)18(14(20)22-12)9-13(19)16-4-6-17(15-21)7-5-16/h2-3,8H,4-7,9H2,1H3