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

Systemtic Name: methyl (NZ)-N-[[(2-benzamido-5-butyl-phenyl)amino]-methylsulfanyl-methylidene]carbamate Openeye Name: methyl (NZ)-N-[(2-benzamido-5-butyl-anilino)-methylsulfanyl-methylene]carbamate CAS Name: (NZ)-N-[(2-benzamido-5-butylanilino)-(methylthio)methylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[(2-benzamido-5-butylanilino)-methylsulfanylmethylidene]carbamate Traditional Name: (NZ)-N-[(2-benzamido-5-butyl-anilino)-(methylthio)methylene]carbamic acid methyl ester Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2)NC(=NC(=O)OC)SC

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2)N/C(=N/C(=O)OC)/SC

InChI

InChI=1S/C21H25N3O3S/c1-4-5-9-15-12-13-17(22-19(25)16-10-7-6-8-11-16)18(14-15)23-20(28-3)24-21(26)27-2/h6-8,10-14H,4-5,9H2,1-3H3,(H,22,25)(H,23,24,26)