N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide Openeye Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-chloro-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxamide CAS Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-chloro-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxamide IUPAC Name: N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-chloro-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide Traditional Name: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-chloro-2-(4-methoxyphenyl)-3-methyl-cinchoninamide Formula: C27H24ClN3O3S MolecularWeight: 506.01576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N)Cl)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N)Cl)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H24ClN3O3S/c1-14-22(26(33)31-27-23(25(29)32)18-5-3-4-6-21(18)35-27)19-13-16(28)9-12-20(19)30-24(14)15-7-10-17(34-2)11-8-15/h7-13H,3-6H2,1-2H3,(H2,29,32)(H,31,33)