N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylpropanoylamino)benzamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylpropanoylamino)benzamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylpropanoylamino)benzamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(2-methylpropanoylamino)benzamide Traditional Name: 3-(isobutyrylamino)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)NC(=O)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)NC(=O)C(C)C

InChI

InChI=1S/C25H23N3O2S/c1-15(2)23(29)27-20-6-4-5-18(14-20)24(30)26-19-10-8-17(9-11-19)25-28-21-12-7-16(3)13-22(21)31-25/h4-15H,1-3H3,(H,26,30)(H,27,29)