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

Systemtic Name: N-[[(3E)-3-(5-chloranyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamothioyl]ethanamide Openeye Name: N-[[(3E)-3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]carbamothioyl]acetamide CAS Name: N-[[[(3E)-3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[[(3E)-3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]acetamide Traditional Name: N-[[(3E)-3-(5-chloro-3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]thiocarbamoyl]acetamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC(=C2NC3=C(O2)C=CC(=C3)Cl)C(=O)C=C1

Isomeric SMILES

CC(=O)NC(=S)NC1=C/C(=C\2/NC3=C(O2)C=CC(=C3)Cl)/C(=O)C=C1

InChI

InChI=1S/C16H12ClN3O3S/c1-8(21)18-16(24)19-10-3-4-13(22)11(7-10)15-20-12-6-9(17)2-5-14(12)23-15/h2-7,20H,1H3,(H2,18,19,21,24)/b15-11+