3-(1,3-benzodioxol-5-ylmethyl)-1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methyl-thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methyl-thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methylthiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methylthiourea Traditional Name: 1-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-1-methyl-3-piperonyl-thiourea Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N3O2S2/c1-12(18-21-14-5-3-4-6-17(14)26-18)22(2)19(25)20-10-13-7-8-15-16(9-13)24-11-23-15/h3-9,12H,10-11H2,1-2H3,(H,20,25)/t12-/m1/s1