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

Systemtic Name: 3-chloranyl-4-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C19H20ClN3O5S2 MolecularWeight: 469.9622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O5S2/c1-27-17-7-2-13(12-16(17)20)18(24)22-19(29)21-14-3-5-15(6-4-14)30(25,26)23-8-10-28-11-9-23/h2-7,12H,8-11H2,1H3,(H2,21,22,24,29)