1-butyl-3-(5-chloranyl-2-piperidin-1-yl-phenyl)thiourea

Systemtic Name: 1-butyl-3-(5-chloranyl-2-piperidin-1-yl-phenyl)thiourea Openeye Name: 1-butyl-3-[5-chloro-2-(1-piperidyl)phenyl]thiourea CAS Name: 1-butyl-3-[5-chloro-2-(1-piperidinyl)phenyl]thiourea IUPAC Name: 1-butyl-3-(5-chloro-2-piperidin-1-ylphenyl)thiourea Traditional Name: 1-butyl-3-(5-chloro-2-piperidino-phenyl)thiourea Formula: C16H24ClN3S MolecularWeight: 325.89986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(C=CC(=C1)Cl)N2CCCCC2

Isomeric SMILES

CCCCNC(=S)NC1=C(C=CC(=C1)Cl)N2CCCCC2

InChI

InChI=1S/C16H24ClN3S/c1-2-3-9-18-16(21)19-14-12-13(17)7-8-15(14)20-10-5-4-6-11-20/h7-8,12H,2-6,9-11H2,1H3,(H2,18,19,21)