1-(2-methylphenyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea Openeye Name: 1-[2-(4-nitroanilino)ethyl]-3-(o-tolyl)thiourea CAS Name: 1-(2-methylphenyl)-3-[2-(4-nitroanilino)ethyl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[2-(4-nitroanilino)ethyl]thiourea Traditional Name: 1-[2-(4-nitroanilino)ethyl]-3-(o-tolyl)thiourea Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O2S/c1-12-4-2-3-5-15(12)19-16(23)18-11-10-17-13-6-8-14(9-7-13)20(21)22/h2-9,17H,10-11H2,1H3,(H2,18,19,23)