1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-methylphenyl)thiourea

Systemtic Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-methylphenyl)thiourea Openeye Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(m-tolyl)thiourea CAS Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(3-methylphenyl)thiourea Traditional Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(m-tolyl)thiourea Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC(C)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N[C@H](C)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H20N2O2S/c1-12-4-3-5-15(10-12)20-18(23)19-13(2)14-6-7-16-17(11-14)22-9-8-21-16/h3-7,10-11,13H,8-9H2,1-2H3,(H2,19,20,23)/t13-/m1/s1