methyl 4-[(diphenylamino)carbamothioylamino]butanoate

Systemtic Name: methyl 4-[(diphenylamino)carbamothioylamino]butanoate Openeye Name: methyl 4-[(N-phenylanilino)carbamothioylamino]butanoate CAS Name: 4-[[(2,2-diphenylhydrazinyl)-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(N-phenylanilino)carbamothioylamino]butanoate Traditional Name: 4-[(N-phenylanilino)thiocarbamoylamino]butyric acid methyl ester Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)NN(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCNC(=S)NN(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O2S/c1-23-17(22)13-8-14-19-18(24)20-21(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12H,8,13-14H2,1H3,(H2,19,20,24)