N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3,5-bis(chloranyl)-4-methoxy-benzamide

Systemtic Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3,5-bis(chloranyl)-4-methoxy-benzamide Openeye Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3,5-dichloro-4-methoxy-benzamide CAS Name: N-[[(6-acetamido-1,3-benzoxazol-2-yl)amino]-sulfanylidenemethyl]-3,5-dichloro-4-methoxybenzamide IUPAC Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)carbamothioyl]-3,5-dichloro-4-methoxybenzamide Traditional Name: N-[(6-acetamido-1,3-benzoxazol-2-yl)thiocarbamoyl]-3,5-dichloro-4-methoxy-benzamide Formula: C18H14Cl2N4O4S MolecularWeight: 453.29916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(O2)NC(=S)NC(=O)C3=CC(=C(C(=C3)Cl)OC)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(O2)NC(=S)NC(=O)C3=CC(=C(C(=C3)Cl)OC)Cl

InChI

InChI=1S/C18H14Cl2N4O4S/c1-8(25)21-10-3-4-13-14(7-10)28-17(22-13)24-18(29)23-16(26)9-5-11(19)15(27-2)12(20)6-9/h3-7H,1-2H3,(H,21,25)(H2,22,23,24,26,29)