1-[4-(diethylamino)-2-methyl-phenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-[4-(diethylamino)-2-methyl-phenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-[4-(diethylamino)-2-methyl-phenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-[4-(diethylamino)-2-methylphenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-[4-(diethylamino)-2-methylphenyl]-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-[4-(diethylamino)-2-methyl-phenyl]-3-homoveratryl-thiourea Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C22H31N3O2S/c1-6-25(7-2)18-9-10-19(16(3)14-18)24-22(28)23-13-12-17-8-11-20(26-4)21(15-17)27-5/h8-11,14-15H,6-7,12-13H2,1-5H3,(H2,23,24,28)