1-methyl-3-(4-nitrophenyl)-1-[(2-piperidin-1-ylphenyl)methyl]thiourea

Systemtic Name: 1-methyl-3-(4-nitrophenyl)-1-[(2-piperidin-1-ylphenyl)methyl]thiourea Openeye Name: 1-methyl-3-(4-nitrophenyl)-1-[[2-(1-piperidyl)phenyl]methyl]thiourea CAS Name: 1-methyl-3-(4-nitrophenyl)-1-[[2-(1-piperidinyl)phenyl]methyl]thiourea IUPAC Name: 1-methyl-3-(4-nitrophenyl)-1-[(2-piperidin-1-ylphenyl)methyl]thiourea Traditional Name: 1-methyl-3-(4-nitrophenyl)-1-(2-piperidinobenzyl)thiourea Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O2S/c1-22(20(27)21-17-9-11-18(12-10-17)24(25)26)15-16-7-3-4-8-19(16)23-13-5-2-6-14-23/h3-4,7-12H,2,5-6,13-15H2,1H3,(H,21,27)