(2S)-2-[3-(1H-indol-3-yl)prop-2-enoylamino]-3-oxidanyl-N-quinolin-6-yl-propanamide

Systemtic Name: (2S)-2-[3-(1H-indol-3-yl)prop-2-enoylamino]-3-oxidanyl-N-quinolin-6-yl-propanamide Openeye Name: (2S)-3-hydroxy-2-[3-(1H-indol-3-yl)prop-2-enoylamino]-N-(6-quinolyl)propanamide CAS Name: (2S)-3-hydroxy-2-[[3-(1H-indol-3-yl)-1-oxoprop-2-enyl]amino]-N-(6-quinolinyl)propanamide IUPAC Name: (2S)-3-hydroxy-2-[3-(1H-indol-3-yl)prop-2-enoylamino]-N-quinolin-6-ylpropanamide Traditional Name: (2S)-3-hydroxy-2-[[3-(1H-indol-3-yl)acryloyl]amino]-N-(6-quinolyl)propionamide Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C=CC(=O)NC(CO)C(=O)NC3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C=CC(=O)N[C@@H](CO)C(=O)NC3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C23H20N4O3/c28-14-21(23(30)26-17-8-9-19-15(12-17)4-3-11-24-19)27-22(29)10-7-16-13-25-20-6-2-1-5-18(16)20/h1-13,21,25,28H,14H2,(H,26,30)(H,27,29)/t21-/m0/s1