N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methyl-butanamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methyl-butanamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methyl-butanamide CAS Name: 3-methyl-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]butanamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-3-methylbutanamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)-3-methyl-butyramide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CC(C)C

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CC(C)C

InChI

InChI=1S/C16H21N3O2S/c1-4-5-14(20)19-16-18-12-7-6-11(9-13(12)22-16)17-15(21)8-10(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,17,21)(H,18,19,20)