N'-[1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-4-phenyl-butan-2-yl]-2-methyl-pentanediamide

Systemtic Name: N'-[1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-4-phenyl-butan-2-yl]-2-methyl-pentanediamide Openeye Name: N'-[1-(1,3-benzothiazole-2-carbonyl)-3-phenyl-propyl]-2-methyl-pentanediamide CAS Name: N'-[1-(1,3-benzothiazol-2-yl)-1-oxo-4-phenylbutan-2-yl]-2-methylpentanediamide IUPAC Name: N'-[1-(1,3-benzothiazol-2-yl)-1-oxo-4-phenylbutan-2-yl]-2-methylpentanediamide Traditional Name: N'-[1-(1,3-benzothiazole-2-carbonyl)-3-phenyl-propyl]-2-methyl-glutaramide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CCC1=CC=CC=C1)C(=O)C2=NC3=CC=CC=C3S2)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CCC1=CC=CC=C1)C(=O)C2=NC3=CC=CC=C3S2)C(=O)N

InChI

InChI=1S/C23H25N3O3S/c1-15(22(24)29)11-14-20(27)25-18(13-12-16-7-3-2-4-8-16)21(28)23-26-17-9-5-6-10-19(17)30-23/h2-10,15,18H,11-14H2,1H3,(H2,24,29)(H,25,27)