propan-2-yl (NZ)-N-[[(2-acetamido-5-butyl-phenyl)amino]-methylsulfanyl-methylidene]carbamate

Systemtic Name: propan-2-yl (NZ)-N-[[(2-acetamido-5-butyl-phenyl)amino]-methylsulfanyl-methylidene]carbamate Openeye Name: isopropyl (NZ)-N-[(2-acetamido-5-butyl-anilino)-methylsulfanyl-methylene]carbamate CAS Name: (NZ)-N-[(2-acetamido-5-butylanilino)-(methylthio)methylidene]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl (NZ)-N-[(2-acetamido-5-butylanilino)-methylsulfanylmethylidene]carbamate Traditional Name: (NZ)-N-[(2-acetamido-5-butyl-anilino)-(methylthio)methylene]carbamic acid isopropyl ester Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O3S/c1-6-7-8-14-9-10-15(19-13(4)22)16(11-14)20-17(25-5)21-18(23)24-12(2)3/h9-12H,6-8H2,1-5H3,(H,19,22)(H,20,21,23)