methyl N-[(2-azanyl-4-cyclopentylsulfanyl-phenyl)carbamothioyl]carbamate

Systemtic Name: methyl N-[(2-azanyl-4-cyclopentylsulfanyl-phenyl)carbamothioyl]carbamate Openeye Name: methyl N-[(2-amino-4-cyclopentylsulfanyl-phenyl)carbamothioyl]carbamate CAS Name: N-[[2-amino-4-(cyclopentylthio)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2-amino-4-cyclopentylsulfanylphenyl)carbamothioyl]carbamate Traditional Name: N-[[2-amino-4-(cyclopentylthio)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C14H19N3O2S2 MolecularWeight: 325.44956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2CCCC2)N

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2CCCC2)N

InChI

InChI=1S/C14H19N3O2S2/c1-19-14(18)17-13(20)16-12-7-6-10(8-11(12)15)21-9-4-2-3-5-9/h6-9H,2-5,15H2,1H3,(H2,16,17,18,20)