N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[(6-butyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-isobutoxy-benzamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC(=CC=C3)OCC(C)C

InChI

InChI=1S/C23H27N3O2S2/c1-4-5-7-16-10-11-19-20(12-16)30-23(24-19)26-22(29)25-21(27)17-8-6-9-18(13-17)28-14-15(2)3/h6,8-13,15H,4-5,7,14H2,1-3H3,(H2,24,25,26,27,29)