1-[2-(4-nitrophenyl)sulfanylethanoylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-(4-nitrophenyl)sulfanylethanoylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea CAS Name: 1-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 1-benzyl-3-[[2-[(4-nitrophenyl)thio]acetyl]amino]thiourea Formula: C16H16N4O3S2 MolecularWeight: 376.45324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O3S2/c21-15(11-25-14-8-6-13(7-9-14)20(22)23)18-19-16(24)17-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,18,21)(H2,17,19,24)