N-[(2S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[(4,6-dimethyl-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NC2=NC3=C(C=C(C=C3S2)C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NC2=NC3=C(C=C(C=C3S2)C)C

InChI

InChI=1S/C22H25N3O2S/c1-12(2)18(23-20(26)16-9-7-6-8-14(16)4)21(27)25-22-24-19-15(5)10-13(3)11-17(19)28-22/h6-12,18H,1-5H3,(H,23,26)(H,24,25,27)/t18-/m0/s1