N-[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]ethanamide

Systemtic Name: N-[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]ethanamide Openeye Name: N-[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]carbamothioyl]acetamide CAS Name: N-[[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]acetamide Traditional Name: N-[[(4E)-4-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]thiocarbamoyl]acetamide Formula: C18H17N3O3S MolecularWeight: 355.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C3C=CC(=CC3=O)NC(=S)NC(=O)C)N2

Isomeric SMILES

CCC1=CC2=C(C=C1)O/C(=C/3\C=CC(=CC3=O)NC(=S)NC(=O)C)/N2

InChI

InChI=1S/C18H17N3O3S/c1-3-11-4-7-16-14(8-11)21-17(24-16)13-6-5-12(9-15(13)23)20-18(25)19-10(2)22/h4-9,21H,3H2,1-2H3,(H2,19,20,22,25)/b17-13+