N-cyclopropyl-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxidanylidene-propan-2-yl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[(2,4-dimethylphenyl)carbamoylamino]-1-methyl-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[1-[[(2,4-dimethylanilino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[1-[(2,4-dimethylphenyl)carbamoylamino]-1-oxopropan-2-yl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-[(2,4-dimethylphenyl)carbamoylamino]-2-keto-1-methyl-ethyl]thio]cinchoninamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

InChI

InChI=1S/C25H26N4O3S/c1-14-8-11-20(15(2)12-14)28-25(32)29-23(30)16(3)33-22-13-19(24(31)26-17-9-10-17)18-6-4-5-7-21(18)27-22/h4-8,11-13,16-17H,9-10H2,1-3H3,(H,26,31)(H2,28,29,30,32)