(E)-[azanyl-[4-[3-(2-methyl-6-morpholin-4-yl-phenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophen-2-yl]methylidene]carbamic acid

Systemtic Name: (E)-[azanyl-[4-[3-(2-methyl-6-morpholin-4-yl-phenyl)phenyl]sulfonyl-5-methylsulfanyl-thiophen-2-yl]methylidene]carbamic acid Openeye Name: (E)-[amino-[4-[3-(2-methyl-6-morpholino-phenyl)phenyl]sulfonyl-5-methylsulfanyl-2-thienyl]methylene]carbamic acid CAS Name: (E)-[amino-[4-[3-[2-methyl-6-(4-morpholinyl)phenyl]phenyl]sulfonyl-5-(methylthio)-2-thiophenyl]methylidene]carbamic acid IUPAC Name: (E)-[amino-[4-[3-(2-methyl-6-morpholin-4-ylphenyl)phenyl]sulfonyl-5-methylsulfanylthiophen-2-yl]methylidene]carbamic acid Traditional Name: (E)-[amino-[4-[3-(2-methyl-6-morpholino-phenyl)phenyl]sulfonyl-5-(methylthio)-2-thienyl]methylene]carbamic acid Formula: C24H25N3O5S3 MolecularWeight: 531.6674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCOCC2)C3=CC(=CC=C3)S(=O)(=O)C4=C(SC(=C4)C(=NC(=O)O)N)SC

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCOCC2)C3=CC(=CC=C3)S(=O)(=O)C4=C(SC(=C4)/C(=N\C(=O)O)/N)SC

InChI

InChI=1S/C24H25N3O5S3/c1-15-5-3-8-18(27-9-11-32-12-10-27)21(15)16-6-4-7-17(13-16)35(30,31)20-14-19(34-23(20)33-2)22(25)26-24(28)29/h3-8,13-14H,9-12H2,1-2H3,(H2,25,26)(H,28,29)