1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-phenethyl-thiourea

Systemtic Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-phenethyl-thiourea Openeye Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-phenethyl-thiourea CAS Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-phenethylthiourea IUPAC Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-phenethylthiourea Traditional Name: 1-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-phenethyl-thiourea Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCO2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2S/c1-15(2)20(17-8-9-18-19(14-17)25-13-12-24-18)23-21(26)22-11-10-16-6-4-3-5-7-16/h3-9,14-15,20H,10-13H2,1-2H3,(H2,22,23,26)/t20-/m1/s1