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

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-(3-nitrophenyl)-3-[1-(o-tolylmethyl)pyrazol-3-yl]thiourea CAS Name: 1-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[1-(2-methylbenzyl)pyrazol-3-yl]-3-(3-nitrophenyl)thiourea Formula: C18H17N5O2S MolecularWeight: 367.42488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O2S/c1-13-5-2-3-6-14(13)12-22-10-9-17(21-22)20-18(26)19-15-7-4-8-16(11-15)23(24)25/h2-11H,12H2,1H3,(H2,19,20,21,26)