methyl (NZ)-N-[azanyl-[[2-(methylcarbamoylamino)-4-phenylsulfanyl-phenyl]-propanoyl-amino]methylidene]carbamate

Systemtic Name: methyl (NZ)-N-[azanyl-[[2-(methylcarbamoylamino)-4-phenylsulfanyl-phenyl]-propanoyl-amino]methylidene]carbamate Openeye Name: methyl (NZ)-N-[amino-[2-(methylcarbamoylamino)-4-phenylsulfanyl-N-propanoyl-anilino]methylene]carbamate CAS Name: (NZ)-N-[amino-[2-(methylcarbamoylamino)-N-(1-oxopropyl)-4-(phenylthio)anilino]methylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[amino-[2-(methylcarbamoylamino)-4-phenylsulfanyl-N-propanoylanilino]methylidene]carbamate Traditional Name: (NZ)-N-[amino-[2-(methylcarbamoylamino)-4-(phenylthio)-N-propionyl-anilino]methylene]carbamic acid methyl ester Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=O)NC)C(=NC(=O)OC)N

Isomeric SMILES

CCC(=O)N(C1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=O)NC)/C(=N\C(=O)OC)/N

InChI

InChI=1S/C20H23N5O4S/c1-4-17(26)25(18(21)24-20(28)29-3)16-11-10-14(12-15(16)23-19(27)22-2)30-13-8-6-5-7-9-13/h5-12H,4H2,1-3H3,(H2,21,24,28)(H2,22,23,27)