1-[3-(diethylaminomethyl)-4-methoxy-phenyl]-3-(4-pentoxyphenyl)thiourea hydrochloride

Systemtic Name: 1-[3-(diethylaminomethyl)-4-methoxy-phenyl]-3-(4-pentoxyphenyl)thiourea hydrochloride Openeye Name: 1-[3-(diethylaminomethyl)-4-methoxy-phenyl]-3-(4-pentoxyphenyl)thiourea hydrochloride CAS Name: 1-[3-(diethylaminomethyl)-4-methoxyphenyl]-3-(4-pentoxyphenyl)thiourea hydrochloride IUPAC Name: 1-[3-(diethylaminomethyl)-4-methoxyphenyl]-3-(4-pentoxyphenyl)thiourea hydrochloride Traditional Name: 1-(4-amoxyphenyl)-3-[3-(diethylaminomethyl)-4-methoxy-phenyl]thiourea hydrochloride Formula: C24H36ClN3O2S MolecularWeight: 466.07954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OC)CN(CC)CC.Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)OC)CN(CC)CC.Cl

InChI

InChI=1S/C24H35N3O2S.ClH/c1-5-8-9-16-29-22-13-10-20(11-14-22)25-24(30)26-21-12-15-23(28-4)19(17-21)18-27(6-2)7-3;/h10-15,17H,5-9,16,18H2,1-4H3,(H2,25,26,30);1H