(3R)-N-[2-[(3S)-3-azanylpyrrolidin-1-yl]-6-chloranyl-quinolin-5-yl]-3-phenyl-butanamide

Systemtic Name: (3R)-N-[2-[(3S)-3-azanylpyrrolidin-1-yl]-6-chloranyl-quinolin-5-yl]-3-phenyl-butanamide Openeye Name: (3R)-N-[2-[(3S)-3-aminopyrrolidin-1-yl]-6-chloro-5-quinolyl]-3-phenyl-butanamide CAS Name: (3R)-N-[2-[(3S)-3-amino-1-pyrrolidinyl]-6-chloro-5-quinolinyl]-3-phenylbutanamide IUPAC Name: (3R)-N-[2-[(3S)-3-aminopyrrolidin-1-yl]-6-chloroquinolin-5-yl]-3-phenylbutanamide Traditional Name: (3R)-N-[2-[(3S)-3-aminopyrrolidino]-6-chloro-5-quinolyl]-3-phenyl-butyramide Formula: C23H25ClN4O MolecularWeight: 408.9238

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C=CC2=C1C=CC(=N2)N3CCC(C3)N)Cl)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CC(=O)NC1=C(C=CC2=C1C=CC(=N2)N3CC[C@@H](C3)N)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O/c1-15(16-5-3-2-4-6-16)13-22(29)27-23-18-7-10-21(28-12-11-17(25)14-28)26-20(18)9-8-19(23)24/h2-10,15,17H,11-14,25H2,1H3,(H,27,29)/t15-,17+/m1/s1