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

Systemtic Name: N-[(6R)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-6-chloranyl-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-6-chloro-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-6-chloro-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-6-chloro-2-phenylquinoline-4-carboxamide Traditional Name: N-[(6R)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-6-chloro-2-phenyl-cinchoninamide Formula: C26H22ClN3O2S MolecularWeight: 475.98978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H22ClN3O2S/c1-14-7-9-17-22(11-14)33-26(23(17)24(28)31)30-25(32)19-13-21(15-5-3-2-4-6-15)29-20-10-8-16(27)12-18(19)20/h2-6,8,10,12-14H,7,9,11H2,1H3,(H2,28,31)(H,30,32)/t14-/m1/s1