1-(3,4-dimethylphenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O3S/c1-10-6-7-13(8-11(10)2)17-16(24)19-18-15(21)12-4-3-5-14(9-12)20(22)23/h3-9H,1-2H3,(H,18,21)(H2,17,19,24)