2-[2-[[(1R)-1-cyclopropylethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylquinoline-4-carboxamide

Systemtic Name: 2-[2-[[(1R)-1-cyclopropylethyl]-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanylquinoline-4-carboxamide Openeye Name: 2-[2-[benzyl-[(1R)-1-cyclopropylethyl]amino]-2-oxo-ethyl]sulfanylquinoline-4-carboxamide CAS Name: 2-[[2-[[(1R)-1-cyclopropylethyl]-(phenylmethyl)amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: 2-[2-[benzyl-[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[2-[benzyl-[(1R)-1-cyclopropylethyl]amino]-2-keto-ethyl]thio]cinchoninamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)N

Isomeric SMILES

C[C@H](C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=C3)C(=O)N

InChI

InChI=1S/C24H25N3O2S/c1-16(18-11-12-18)27(14-17-7-3-2-4-8-17)23(28)15-30-22-13-20(24(25)29)19-9-5-6-10-21(19)26-22/h2-10,13,16,18H,11-12,14-15H2,1H3,(H2,25,29)/t16-/m1/s1