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

Systemtic Name: methyl N-[2-oxidanylidene-2-[[2-(pyridin-3-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate Openeye Name: methyl N-[2-oxo-2-[[2-(3-pyridylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate CAS Name: N-[2-oxo-2-[[2-(3-pyridinylmethylthio)-1,3-benzothiazol-6-yl]amino]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-oxo-2-[[2-(pyridin-3-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl]carbamate Traditional Name: N-[2-keto-2-[[2-(3-pyridylmethylthio)-1,3-benzothiazol-6-yl]amino]ethyl]carbamic acid methyl ester Formula: C17H16N4O3S2 MolecularWeight: 388.46394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CN=CC=C3

Isomeric SMILES

COC(=O)NCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CN=CC=C3

InChI

InChI=1S/C17H16N4O3S2/c1-24-16(23)19-9-15(22)20-12-4-5-13-14(7-12)26-17(21-13)25-10-11-3-2-6-18-8-11/h2-8H,9-10H2,1H3,(H,19,23)(H,20,22)