N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-2-(1,3-benzothiazol-2-ylamino)-1-methyl-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl]-3-methylbenzamide Traditional Name: N-[(1S)-2-(1,3-benzothiazol-2-ylamino)-2-keto-1-methyl-ethyl]-3-methyl-benzamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17N3O2S/c1-11-6-5-7-13(10-11)17(23)19-12(2)16(22)21-18-20-14-8-3-4-9-15(14)24-18/h3-10,12H,1-2H3,(H,19,23)(H,20,21,22)/t12-/m0/s1