methyl N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate

Systemtic Name: methyl N-[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate Openeye Name: methyl N-[2-[[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[2-oxo-2-[[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-oxo-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate Traditional Name: N-[2-[[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]-2-keto-ethyl]carbamic acid methyl ester Formula: C16H21N3O3S3 MolecularWeight: 399.55124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)OC

Isomeric SMILES

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)OC

InChI

InChI=1S/C16H21N3O3S3/c1-10(2)23-6-7-24-16-19-12-5-4-11(8-13(12)25-16)18-14(20)9-17-15(21)22-3/h4-5,8,10H,6-7,9H2,1-3H3,(H,17,21)(H,18,20)