1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-4-methyl-phenyl)-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-4-methylphenyl)-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-4-methylphenyl)-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2-methoxy-4-methyl-phenyl)-1-p-anisyl-1-piperonyl-thiourea Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)OC)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)OC)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C25H26N2O4S/c1-17-4-10-21(23(12-17)29-3)26-25(32)27(14-18-5-8-20(28-2)9-6-18)15-19-7-11-22-24(13-19)31-16-30-22/h4-13H,14-16H2,1-3H3,(H,26,32)