1-(2-ethyl-6-methyl-phenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(3-nitrobenzoyl)amino]thiourea Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N4O3S/c1-3-12-7-4-6-11(2)15(12)18-17(25)20-19-16(22)13-8-5-9-14(10-13)21(23)24/h4-10H,3H2,1-2H3,(H,19,22)(H2,18,20,25)