(2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-quinolin-2-yl-propanamide

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-quinolin-2-yl-propanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-quinolyl)propanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-(2-quinolinyl)propanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-quinolin-2-ylpropanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-(2-quinolyl)propionamide Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=CC=CC=C2C=C1)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NC1=NC2=CC=CC=C2C=C1)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C19H16N4O3S/c1-12(20-18-14-7-3-5-9-16(14)27(25,26)23-18)19(24)22-17-11-10-13-6-2-4-8-15(13)21-17/h2-12H,1H3,(H,20,23)(H,21,22,24)/t12-/m0/s1