N-benzo[e][1,3]benzothiazol-2-yl-3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-3-[(3S)-2-keto-3,4-dihydro-1H-quinolin-3-yl]propionamide Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C21)CCC(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1[C@@H](C(=O)NC2=CC=CC=C21)CCC(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C23H19N3O2S/c27-20(12-10-16-13-15-6-2-4-8-18(15)24-22(16)28)25-23-26-21-17-7-3-1-5-14(17)9-11-19(21)29-23/h1-9,11,16H,10,12-13H2,(H,24,28)(H,25,26,27)/t16-/m0/s1