1-(4-methyl-2-nitro-phenyl)-3-(1-phenylethyl)thiourea

Systemtic Name: 1-(4-methyl-2-nitro-phenyl)-3-(1-phenylethyl)thiourea Openeye Name: 1-(4-methyl-2-nitro-phenyl)-3-(1-phenylethyl)thiourea CAS Name: 1-(4-methyl-2-nitrophenyl)-3-(1-phenylethyl)thiourea IUPAC Name: 1-(4-methyl-2-nitrophenyl)-3-(1-phenylethyl)thiourea Traditional Name: 1-(4-methyl-2-nitro-phenyl)-3-(1-phenylethyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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