N-cyclopropyl-2-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-[ethyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-[ethyl(2-thenyl)amino]-2-keto-ethyl]thio]cinchoninamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CS1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

Isomeric SMILES

CCN(CC1=CC=CS1)C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4

InChI

InChI=1S/C22H23N3O2S2/c1-2-25(13-16-6-5-11-28-16)21(26)14-29-20-12-18(22(27)23-15-9-10-15)17-7-3-4-8-19(17)24-20/h3-8,11-12,15H,2,9-10,13-14H2,1H3,(H,23,27)