N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]pentanamide

Systemtic Name: N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]pentanamide Openeye Name: N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]pentanamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]-1,3-benzothiazol-5-yl]pentanamide IUPAC Name: N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]pentanamide Traditional Name: N-[2-(isobutyrylamino)-1,3-benzothiazol-5-yl]valeramide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)SC(=N2)NC(=O)C(C)C

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)SC(=N2)NC(=O)C(C)C

InChI

InChI=1S/C16H21N3O2S/c1-4-5-6-14(20)17-11-7-8-13-12(9-11)18-16(22-13)19-15(21)10(2)3/h7-10H,4-6H2,1-3H3,(H,17,20)(H,18,19,21)