(3S)-N-[(2S)-1-azanyl-3,3-dimethyl-1-oxidanylidene-butan-2-yl]-N'-methoxy-3-oxidanyl-2-quinolin-3-yl-butanediamide

Systemtic Name: (3S)-N-[(2S)-1-azanyl-3,3-dimethyl-1-oxidanylidene-butan-2-yl]-N'-methoxy-3-oxidanyl-2-quinolin-3-yl-butanediamide Openeye Name: (3S)-N-[(1S)-1-carbamoyl-2,2-dimethyl-propyl]-3-hydroxy-N'-methoxy-2-(3-quinolyl)butanediamide CAS Name: (3S)-N-[(2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl]-3-hydroxy-N'-methoxy-2-(3-quinolinyl)butanediamide IUPAC Name: (3S)-N-[(2S)-1-amino-3,3-dimethyl-1-oxobutan-2-yl]-3-hydroxy-N'-methoxy-2-quinolin-3-ylbutanediamide Traditional Name: (3S)-N-[(1S)-1-carbamoyl-2,2-dimethyl-propyl]-3-hydroxy-N'-methoxy-2-(3-quinolyl)succinamide Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N)NC(=O)C(C1=CC2=CC=CC=C2N=C1)C(C(=O)NOC)O

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N)NC(=O)C(C1=CC2=CC=CC=C2N=C1)[C@@H](C(=O)NOC)O

InChI

InChI=1S/C20H26N4O5/c1-20(2,3)16(17(21)26)23-18(27)14(15(25)19(28)24-29-4)12-9-11-7-5-6-8-13(11)22-10-12/h5-10,14-16,25H,1-4H3,(H2,21,26)(H,23,27)(H,24,28)/t14?,15-,16+/m0/s1