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

Systemtic Name: 3-(2-nitrophenyl)-1-(1-phenethylpiperidin-4-yl)-1-propyl-thiourea Openeye Name: 3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidyl)-1-propyl-thiourea CAS Name: 3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidinyl)-1-propylthiourea IUPAC Name: 3-(2-nitrophenyl)-1-(1-phenethylpiperidin-4-yl)-1-propylthiourea Traditional Name: 3-(2-nitrophenyl)-1-(1-phenethyl-4-piperidyl)-1-propyl-thiourea Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O2S/c1-2-15-26(23(30)24-21-10-6-7-11-22(21)27(28)29)20-13-17-25(18-14-20)16-12-19-8-4-3-5-9-19/h3-11,20H,2,12-18H2,1H3,(H,24,30)