(2S)-2-azanyl-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: (2S)-2-azanyl-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide Openeye Name: (2S)-2-amino-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide CAS Name: (2S)-2-amino-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide IUPAC Name: (2S)-2-amino-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pentanamide Traditional Name: (2S)-2-amino-4-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)valeramide Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CC(C)C)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H](CC(C)C)N

InChI

InChI=1S/C14H19N3OS/c1-8(2)6-10(15)13(18)17-14-16-11-5-4-9(3)7-12(11)19-14/h4-5,7-8,10H,6,15H2,1-3H3,(H,16,17,18)/t10-/m0/s1