1-[[(1R)-6,7-dimethoxy-2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethyl-thiourea

Systemtic Name: 1-[[(1R)-6,7-dimethoxy-2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethyl-thiourea Openeye Name: 1-[[(1R)-6,7-dimethoxy-2-(m-tolylmethyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethyl-thiourea CAS Name: 1-[[(1R)-6,7-dimethoxy-2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethylthiourea IUPAC Name: 1-[[(1R)-6,7-dimethoxy-2-[(3-methylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethylthiourea Traditional Name: 1-[[(1R)-6,7-dimethoxy-2-(3-methylbenzyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-ethyl-thiourea Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1C2=CC(=C(C=C2CCN1CC3=CC=CC(=C3)C)OC)OC

Isomeric SMILES

CCNC(=S)NC[C@H]1C2=CC(=C(C=C2CCN1CC3=CC=CC(=C3)C)OC)OC

InChI

InChI=1S/C23H31N3O2S/c1-5-24-23(29)25-14-20-19-13-22(28-4)21(27-3)12-18(19)9-10-26(20)15-17-8-6-7-16(2)11-17/h6-8,11-13,20H,5,9-10,14-15H2,1-4H3,(H2,24,25,29)/t20-/m0/s1