N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide Openeye Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide CAS Name: N-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[(6-butyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-methyl-propionamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C(C)C

InChI

InChI=1S/C16H21N3OS2/c1-4-5-6-11-7-8-12-13(9-11)22-16(17-12)19-15(21)18-14(20)10(2)3/h7-10H,4-6H2,1-3H3,(H2,17,18,19,20,21)