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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]thiourea Traditional Name: 1-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-3-piperonyl-thiourea Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H22N2O3S/c1-12-4-6-16(22-3)15(8-12)13(2)21-19(25)20-10-14-5-7-17-18(9-14)24-11-23-17/h4-9,13H,10-11H2,1-3H3,(H2,20,21,25)/t13-/m0/s1