N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2,6-dimethyl-quinoline-4-carboxamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2,6-dimethyl-quinoline-4-carboxamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-2,6-dimethyl-quinoline-4-carboxamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-2,6-dimethyl-4-quinolinecarboxamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2,6-dimethylquinoline-4-carboxamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-2,6-dimethyl-cinchoninamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=NC(=CS3)C4=CC=C(S4)CNC(=O)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=NC(=CS3)C4=CC=C(S4)CNC(=O)C)C

InChI

InChI=1S/C22H20N4O2S2/c1-12-4-6-18-16(8-12)17(9-13(2)24-18)21(28)26-22-25-19(11-29-22)20-7-5-15(30-20)10-23-14(3)27/h4-9,11H,10H2,1-3H3,(H,23,27)(H,25,26,28)