1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methyl-1,3-benzothiazol-6-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methyl-1,3-benzothiazol-6-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methyl-1,3-benzothiazol-6-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methyl-1,3-benzothiazol-6-yl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-methyl-1,3-benzothiazol-6-yl)thiourea Traditional Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-piperonyl-thiourea Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H15N3O2S2/c1-10-19-13-4-3-12(7-16(13)24-10)20-17(23)18-8-11-2-5-14-15(6-11)22-9-21-14/h2-7H,8-9H2,1H3,(H2,18,20,23)