3-(3-methoxypropyl)-1-methyl-1-[[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]carbonylamino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-methylpiperidin-1-yl)-5-nitro-phenyl]carbonylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-methyl-1-piperidyl)-5-nitro-benzoyl]amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[[2-(4-methyl-1-piperidinyl)-5-nitrophenyl]-oxomethyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-methylpiperidin-1-yl)-5-nitrobenzoyl]amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-methylpiperidino)-5-nitro-benzoyl]amino]thiourea Formula: C19H29N5O4S MolecularWeight: 423.52966

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NN(C)C(=S)NCCCOC

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NN(C)C(=S)NCCCOC

InChI

InChI=1S/C19H29N5O4S/c1-14-7-10-23(11-8-14)17-6-5-15(24(26)27)13-16(17)18(25)21-22(2)19(29)20-9-4-12-28-3/h5-6,13-14H,4,7-12H2,1-3H3,(H,20,29)(H,21,25)