N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-2-methyl-benzamide Openeye Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-2-methyl-benzamide CAS Name: N-[[(6-acetamido-1,3-benzoxazol-2-yl)amino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-2-methylbenzamide Traditional Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)thiocarbamoyl]-2-methyl-benzamide Formula: C18H16N4O3S MolecularWeight: 368.40964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)NC2=NC3=C(O2)C=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)NC2=NC3=C(O2)C=C(C=C3)NC(=O)C

InChI

InChI=1S/C18H16N4O3S/c1-10-5-3-4-6-13(10)16(24)21-18(26)22-17-20-14-8-7-12(19-11(2)23)9-15(14)25-17/h3-9H,1-2H3,(H,19,23)(H2,20,21,22,24,26)