ethyl N-[4-methyl-2-(3-methylsulfanylpiperazin-1-yl)phenyl]sulfamate

Systemtic Name: ethyl N-[4-methyl-2-(3-methylsulfanylpiperazin-1-yl)phenyl]sulfamate Openeye Name: ethyl N-[4-methyl-2-(3-methylsulfanylpiperazin-1-yl)phenyl]sulfamate CAS Name: N-[4-methyl-2-[3-(methylthio)-1-piperazinyl]phenyl]sulfamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-2-(3-methylsulfanylpiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[4-methyl-2-[3-(methylthio)piperazino]phenyl]sulfamic acid ethyl ester Formula: C14H23N3O3S2 MolecularWeight: 345.48072

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)NC1=C(C=C(C=C1)C)N2CCNC(C2)SC

Isomeric SMILES

CCOS(=O)(=O)NC1=C(C=C(C=C1)C)N2CCNC(C2)SC

InChI

InChI=1S/C14H23N3O3S2/c1-4-20-22(18,19)16-12-6-5-11(2)9-13(12)17-8-7-15-14(10-17)21-3/h5-6,9,14-16H,4,7-8,10H2,1-3H3