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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-methyl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-methyl-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-methylphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2-methylphenyl)thiourea Traditional Name: 1-(4-methoxy-2-methyl-phenyl)-3-piperonyl-thiourea Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H18N2O3S/c1-11-7-13(20-2)4-5-14(11)19-17(23)18-9-12-3-6-15-16(8-12)22-10-21-15/h3-8H,9-10H2,1-2H3,(H2,18,19,23)