1-methyl-3-(4-nitrophenyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-methyl-3-(4-nitrophenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-methyl-3-(4-nitrophenyl)thiourea CAS Name: 1-methyl-3-(4-nitrophenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-methyl-3-(4-nitrophenyl)thiourea Traditional Name: 1-benzyl-1-methyl-3-(4-nitrophenyl)thiourea Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O2S/c1-17(11-12-5-3-2-4-6-12)15(21)16-13-7-9-14(10-8-13)18(19)20/h2-10H,11H2,1H3,(H,16,21)