(2S)-2-(4-cyanophenoxy)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide

Systemtic Name: (2S)-2-(4-cyanophenoxy)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide Openeye Name: (2S)-2-(4-cyanophenoxy)-N-(2-morpholino-1,3-benzothiazol-6-yl)propanamide CAS Name: (2S)-2-(4-cyanophenoxy)-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: (2S)-2-(4-cyanophenoxy)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide Traditional Name: (2S)-2-(4-cyanophenoxy)-N-(2-morpholino-1,3-benzothiazol-6-yl)propionamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H20N4O3S/c1-14(28-17-5-2-15(13-22)3-6-17)20(26)23-16-4-7-18-19(12-16)29-21(24-18)25-8-10-27-11-9-25/h2-7,12,14H,8-11H2,1H3,(H,23,26)/t14-/m0/s1