1-ethyl-3-(2-nitrophenyl)-1-(1-phenethylpiperidin-4-yl)thiourea

Systemtic Name: 1-ethyl-3-(2-nitrophenyl)-1-(1-phenethylpiperidin-4-yl)thiourea Openeye Name: 1-ethyl-3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidyl)thiourea CAS Name: 1-ethyl-3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidinyl)thiourea IUPAC Name: 1-ethyl-3-(2-nitrophenyl)-1-(1-phenethylpiperidin-4-yl)thiourea Traditional Name: 1-ethyl-3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidyl)thiourea Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCC2=CC=CC=C2)C(=S)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN(C1CCN(CC1)CCC2=CC=CC=C2)C(=S)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O2S/c1-2-25(22(29)23-20-10-6-7-11-21(20)26(27)28)19-13-16-24(17-14-19)15-12-18-8-4-3-5-9-18/h3-11,19H,2,12-17H2,1H3,(H,23,29)