1-(4-ethanoylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea

Systemtic Name: 1-(4-ethanoylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea Openeye Name: 1-(4-acetylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[4-(2-nitrophenyl)phenyl]thiourea Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O3S/c1-14(25)15-6-10-17(11-7-15)22-21(28)23-18-12-8-16(9-13-18)19-4-2-3-5-20(19)24(26)27/h2-13H,1H3,(H2,22,23,28)