tert-butyl N-[[5-[[azanyl(ethylsulfanyl)methylidene]amino]-2-pyrazol-1-yl-phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[5-[[azanyl(ethylsulfanyl)methylidene]amino]-2-pyrazol-1-yl-phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[5-[[amino(ethylsulfanyl)methylene]amino]-2-pyrazol-1-yl-phenyl]methyl]carbamate CAS Name: N-[[5-[[amino-(ethylthio)methylidene]amino]-2-(1-pyrazolyl)phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[5-[[amino(ethylsulfanyl)methylidene]amino]-2-pyrazol-1-ylphenyl]methyl]carbamate Traditional Name: N-[5-[[amino-(ethylthio)methylene]amino]-2-pyrazol-1-yl-benzyl]carbamic acid tert-butyl ester Formula: C18H25N5O2S MolecularWeight: 375.4884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=CC(=C(C=C1)N2C=CC=N2)CNC(=O)OC(C)(C)C)N

Isomeric SMILES

CCSC(=NC1=CC(=C(C=C1)N2C=CC=N2)CNC(=O)OC(C)(C)C)N

InChI

InChI=1S/C18H25N5O2S/c1-5-26-16(19)22-14-7-8-15(23-10-6-9-21-23)13(11-14)12-20-17(24)25-18(2,3)4/h6-11H,5,12H2,1-4H3,(H2,19,22)(H,20,24)