1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-methylsulfonylphenyl)urea

Systemtic Name: 1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-methylsulfonylphenyl)urea Openeye Name: 1-[5-[(6,7-dimethoxy-4-quinolyl)sulfanyl]-2-thienyl]-3-(3-methylsulfonylphenyl)urea CAS Name: 1-[5-[(6,7-dimethoxy-4-quinolinyl)thio]-2-thiophenyl]-3-(3-methylsulfonylphenyl)urea IUPAC Name: 1-[5-(6,7-dimethoxyquinolin-4-yl)sulfanylthiophen-2-yl]-3-(3-methylsulfonylphenyl)urea Traditional Name: 1-[5-[(6,7-dimethoxy-4-quinolyl)thio]-2-thienyl]-3-(3-mesylphenyl)urea Formula: C23H21N3O5S3 MolecularWeight: 515.62494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)SC3=CC=C(S3)NC(=O)NC4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)SC3=CC=C(S3)NC(=O)NC4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C23H21N3O5S3/c1-30-18-12-16-17(13-19(18)31-2)24-10-9-20(16)32-22-8-7-21(33-22)26-23(27)25-14-5-4-6-15(11-14)34(3,28)29/h4-13H,1-3H3,(H2,25,26,27)