1-(3-nitrophenyl)-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea hydrochloride

Systemtic Name: 1-(3-nitrophenyl)-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea hydrochloride Openeye Name: 1-(3-nitrophenyl)-3-[4-(1-piperidylmethyl)phenyl]thiourea hydrochloride CAS Name: 1-(3-nitrophenyl)-3-[4-(1-piperidinylmethyl)phenyl]thiourea hydrochloride IUPAC Name: 1-(3-nitrophenyl)-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea hydrochloride Traditional Name: 1-(3-nitrophenyl)-3-[4-(piperidinomethyl)phenyl]thiourea hydrochloride Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-].Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H22N4O2S.ClH/c24-23(25)18-6-4-5-17(13-18)21-19(26)20-16-9-7-15(8-10-16)14-22-11-2-1-3-12-22;/h4-10,13H,1-3,11-12,14H2,(H2,20,21,26);1H