1-(2-methoxy-4-nitro-phenyl)-3-[(4-methylphenyl)carbamothioylamino]urea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(4-methylphenyl)carbamothioylamino]urea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-(p-tolylcarbamothioylamino)urea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[[(4-methylanilino)-sulfanylidenemethyl]amino]urea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-[(4-methylphenyl)carbamothioylamino]urea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-(p-tolylthiocarbamoylamino)urea Formula: C16H17N5O4S MolecularWeight: 375.40228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NNC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NNC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17N5O4S/c1-10-3-5-11(6-4-10)17-16(26)20-19-15(22)18-13-8-7-12(21(23)24)9-14(13)25-2/h3-9H,1-2H3,(H2,17,20,26)(H2,18,19,22)