1-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethyl-thiourea

Systemtic Name: 1-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethyl-thiourea Openeye Name: 1-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethyl-thiourea CAS Name: 1-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethylthiourea IUPAC Name: 1-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethylthiourea Traditional Name: 1-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-ethyl-thiourea Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1C2=CC(=C(C=C2CC[NH+]1CC=C)OC)OC

Isomeric SMILES

CCNC(=S)NC[C@H]1C2=CC(=C(C=C2CC[NH+]1CC=C)OC)OC

InChI

InChI=1S/C18H27N3O2S/c1-5-8-21-9-7-13-10-16(22-3)17(23-4)11-14(13)15(21)12-20-18(24)19-6-2/h5,10-11,15H,1,6-9,12H2,2-4H3,(H2,19,20,24)/p+1/t15-/m0/s1