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

Systemtic Name: N-[(2S)-1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C(C)C)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H](C(C)C)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C22H25N3O3S/c1-5-28-15-10-11-17-18(12-15)29-22(23-17)25-21(27)19(13(2)3)24-20(26)16-9-7-6-8-14(16)4/h6-13,19H,5H2,1-4H3,(H,24,26)(H,23,25,27)/t19-/m0/s1