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

Systemtic Name: 1-methyl-1-[(2-methylphenyl)methyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-methyl-3-(4-nitrophenyl)-1-(o-tolylmethyl)thiourea CAS Name: 1-methyl-1-[(2-methylphenyl)methyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-methyl-1-[(2-methylphenyl)methyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-methyl-1-(2-methylbenzyl)-3-(4-nitrophenyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN(C)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O2S/c1-12-5-3-4-6-13(12)11-18(2)16(22)17-14-7-9-15(10-8-14)19(20)21/h3-10H,11H2,1-2H3,(H,17,22)