1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(2-methylthiazol-4-yl)phenyl]methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(2-methyl-4-thiazolyl)phenyl]methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]thiourea Traditional Name: 1-[4-(2-methylthiazol-4-yl)benzyl]-3-piperonyl-thiourea Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O2S2/c1-13-23-17(11-27-13)16-5-2-14(3-6-16)9-21-20(26)22-10-15-4-7-18-19(8-15)25-12-24-18/h2-8,11H,9-10,12H2,1H3,(H2,21,22,26)