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

Systemtic Name: N-[(2S)-1-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-11(2)17(23-18(25)14-7-5-4-6-12(14)3)19(26)24-20-22-15-9-8-13(21)10-16(15)27-20/h4-11,17H,1-3H3,(H,23,25)(H,22,24,26)/t17-/m0/s1