1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride

Systemtic Name: 1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride Openeye Name: 1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride CAS Name: 1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride IUPAC Name: 1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride Traditional Name: 1-(4-butoxyphenyl)-3-[4-(2-diethylaminoethyloxy)phenyl]thiourea hydrochloride Formula: C23H34ClN3O2S MolecularWeight: 452.05296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCN(CC)CC.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCN(CC)CC.Cl

InChI

InChI=1S/C23H33N3O2S.ClH/c1-4-7-17-27-21-12-8-19(9-13-21)24-23(29)25-20-10-14-22(15-11-20)28-18-16-26(5-2)6-3;/h8-15H,4-7,16-18H2,1-3H3,(H2,24,25,29);1H