3-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-4-phenylmethoxy-benzamide

Systemtic Name: 3-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-3-methoxy-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 3-methoxy-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]-4-phenylmethoxybenzamide IUPAC Name: 3-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-3-methoxy-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C26H27N3O6S2 MolecularWeight: 541.63908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O6S2/c1-33-24-17-20(7-12-23(24)35-18-19-5-3-2-4-6-19)25(30)28-26(36)27-21-8-10-22(11-9-21)37(31,32)29-13-15-34-16-14-29/h2-12,17H,13-16,18H2,1H3,(H2,27,28,30,36)