1-(2-nitrophenyl)-3-(4-piperidin-1-ylphenyl)thiourea

Systemtic Name: 1-(2-nitrophenyl)-3-(4-piperidin-1-ylphenyl)thiourea Openeye Name: 1-(2-nitrophenyl)-3-[4-(1-piperidyl)phenyl]thiourea CAS Name: 1-(2-nitrophenyl)-3-[4-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-(2-nitrophenyl)-3-(4-piperidin-1-ylphenyl)thiourea Traditional Name: 1-(2-nitrophenyl)-3-(4-piperidinophenyl)thiourea Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O2S/c23-22(24)17-7-3-2-6-16(17)20-18(25)19-14-8-10-15(11-9-14)21-12-4-1-5-13-21/h2-3,6-11H,1,4-5,12-13H2,(H2,19,20,25)