(phenylmethyl) N-(4-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl)carbamate

Systemtic Name: (phenylmethyl) N-(4-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl)carbamate Openeye Name: benzyl N-(4-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl)carbamate CAS Name: N-[4-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4-methylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl)carbamate Traditional Name: N-[4-(methylthio)-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl]carbamic acid benzyl ester Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(C2=C1CCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CSC1=NN=C(C2=C1CCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H17N3O2S/c1-22-15-13-9-5-8-12(13)14(18-19-15)17-16(20)21-10-11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,17,18,20)