1-(1,3-benzothiazol-2-yl)-3-methyl-thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-methyl-thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-methyl-thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-methylthiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-methylthiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-methyl-thiourea Formula: C9H9N3S2 MolecularWeight: 223.31786

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CNC(=S)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C9H9N3S2/c1-10-8(13)12-9-11-6-4-2-3-5-7(6)14-9/h2-5H,1H3,(H2,10,11,12,13)