2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]ethanamide Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]acetamide CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropylethyl]acetamide IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropylethyl]acetamide Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[(1R)-1-cyano-1-cyclopropyl-ethyl]acetamide Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H20N4OS/c1-17(11-18,12-7-8-12)20-15(22)9-21(2)10-16-19-13-5-3-4-6-14(13)23-16/h3-6,12H,7-10H2,1-2H3,(H,20,22)/t17-/m0/s1