5-(1,3-benzothiazol-2-yl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]valeramide Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CCCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CCCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C17H23N3O2S/c1-3-18-17(22)12(2)19-15(21)10-6-7-11-16-20-13-8-4-5-9-14(13)23-16/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3,(H,18,22)(H,19,21)/t12-/m0/s1