1-benzo[e][1,3]benzothiazol-2-yl-3-methyl-thiourea

Systemtic Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-methyl-thiourea Openeye Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-methyl-thiourea CAS Name: 1-(2-benzo[e][1,3]benzothiazolyl)-3-methylthiourea IUPAC Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-methylthiourea Traditional Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-methyl-thiourea Formula: C13H11N3S2 MolecularWeight: 273.37654

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=NC2=C(S1)C=CC3=CC=CC=C32

Isomeric SMILES

CNC(=S)NC1=NC2=C(S1)C=CC3=CC=CC=C32

InChI

InChI=1S/C13H11N3S2/c1-14-12(17)16-13-15-11-9-5-3-2-4-8(9)6-7-10(11)18-13/h2-7H,1H3,(H2,14,15,16,17)