1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(phenylmethyl)-1-propyl-thiourea

Systemtic Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(phenylmethyl)-1-propyl-thiourea Openeye Name: 3-benzyl-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-propyl-thiourea CAS Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(phenylmethyl)-1-propylthiourea IUPAC Name: 3-benzyl-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-propylthiourea Traditional Name: 3-benzyl-1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-propyl-thiourea Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1COC2=CC=CC=C2O1)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCCN(C[C@H]1COC2=CC=CC=C2O1)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2S/c1-2-12-22(20(25)21-13-16-8-4-3-5-9-16)14-17-15-23-18-10-6-7-11-19(18)24-17/h3-11,17H,2,12-15H2,1H3,(H,21,25)/t17-/m0/s1