2-[(3S)-3-azanylpyrrolidin-1-yl]-6-chloranyl-N-[2-(2-chlorophenyl)ethyl]quinoline-5-carboxamide

Systemtic Name: 2-[(3S)-3-azanylpyrrolidin-1-yl]-6-chloranyl-N-[2-(2-chlorophenyl)ethyl]quinoline-5-carboxamide Openeye Name: 2-[(3S)-3-aminopyrrolidin-1-yl]-6-chloro-N-[2-(2-chlorophenyl)ethyl]quinoline-5-carboxamide CAS Name: 2-[(3S)-3-amino-1-pyrrolidinyl]-6-chloro-N-[2-(2-chlorophenyl)ethyl]-5-quinolinecarboxamide IUPAC Name: 2-[(3S)-3-aminopyrrolidin-1-yl]-6-chloro-N-[2-(2-chlorophenyl)ethyl]quinoline-5-carboxamide Traditional Name: 2-[(3S)-3-aminopyrrolidino]-6-chloro-N-[2-(2-chlorophenyl)ethyl]quinoline-5-carboxamide Formula: C22H22Cl2N4O MolecularWeight: 429.34228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=NC3=C(C=C2)C(=C(C=C3)Cl)C(=O)NCCC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(C[C@H]1N)C2=NC3=C(C=C2)C(=C(C=C3)Cl)C(=O)NCCC4=CC=CC=C4Cl

InChI

InChI=1S/C22H22Cl2N4O/c23-17-4-2-1-3-14(17)9-11-26-22(29)21-16-5-8-20(28-12-10-15(25)13-28)27-19(16)7-6-18(21)24/h1-8,15H,9-13,25H2,(H,26,29)/t15-/m0/s1