methyl (NZ)-N-[[[5-butyl-2-(hexanoylamino)phenyl]amino]-methylsulfanyl-methylidene]carbamate

Systemtic Name: methyl (NZ)-N-[[[5-butyl-2-(hexanoylamino)phenyl]amino]-methylsulfanyl-methylidene]carbamate Openeye Name: methyl (NZ)-N-[[5-butyl-2-(hexanoylamino)anilino]-methylsulfanyl-methylene]carbamate CAS Name: (NZ)-N-[[5-butyl-2-(1-oxohexylamino)anilino]-(methylthio)methylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[[5-butyl-2-(hexanoylamino)anilino]-methylsulfanylmethylidene]carbamate Traditional Name: (NZ)-N-[[5-butyl-2-(caproylamino)anilino]-(methylthio)methylene]carbamic acid methyl ester Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=C(C=C(C=C1)CCCC)NC(=NC(=O)OC)SC

Isomeric SMILES

CCCCCC(=O)NC1=C(C=C(C=C1)CCCC)N/C(=N/C(=O)OC)/SC

InChI

InChI=1S/C20H31N3O3S/c1-5-7-9-11-18(24)21-16-13-12-15(10-8-6-2)14-17(16)22-19(27-4)23-20(25)26-3/h12-14H,5-11H2,1-4H3,(H,21,24)(H,22,23,25)