N-[3-aminocarbonyl-4-(4-tert-butylphenyl)-5-methyl-thiophen-2-yl]-2-(2-propan-2-yloxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-aminocarbonyl-4-(4-tert-butylphenyl)-5-methyl-thiophen-2-yl]-2-(2-propan-2-yloxyphenyl)quinoline-4-carboxamide Openeye Name: N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methyl-2-thienyl]-2-(2-isopropoxyphenyl)quinoline-4-carboxamide CAS Name: N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methyl-2-thiophenyl]-2-(2-propan-2-yloxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methylthiophen-2-yl]-2-(2-propan-2-yloxyphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methyl-2-thienyl]-2-(2-isopropoxyphenyl)cinchoninamide Formula: C35H35N3O3S MolecularWeight: 577.7357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4OC(C)C)C(=O)N)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4OC(C)C)C(=O)N)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C35H35N3O3S/c1-20(2)41-29-14-10-8-12-25(29)28-19-26(24-11-7-9-13-27(24)37-28)33(40)38-34-31(32(36)39)30(21(3)42-34)22-15-17-23(18-16-22)35(4,5)6/h7-20H,1-6H3,(H2,36,39)(H,38,40)