N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(3-methylbutoxy)benzamide

Systemtic Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: 2-isopentyloxy-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 2-isoamoxy-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]benzamide Formula: C27H27N3O2S2 MolecularWeight: 489.65218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4OCCC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=CC=C4OCCC(C)C

InChI

InChI=1S/C27H27N3O2S2/c1-17(2)14-15-32-23-7-5-4-6-21(23)25(31)30-27(33)28-20-11-9-19(10-12-20)26-29-22-13-8-18(3)16-24(22)34-26/h4-13,16-17H,14-15H2,1-3H3,(H2,28,30,31,33)