N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]propanamide

Systemtic Name: N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Openeye Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]propanamide CAS Name: N-[[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Traditional Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]propionamide Formula: C12H12ClN3O2S2 MolecularWeight: 329.82558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

Isomeric SMILES

CCC(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

InChI

InChI=1S/C12H12ClN3O2S2/c1-3-10(17)15-11(19)16-12-14-7-4-6(13)8(18-2)5-9(7)20-12/h4-5H,3H2,1-2H3,(H2,14,15,16,17,19)