N-[5-[3-(4-methoxyphenyl)propanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide

Systemtic Name: N-[5-[3-(4-methoxyphenyl)propanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide Openeye Name: N-[5-[3-(4-methoxyphenyl)propanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide CAS Name: N-[5-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-1,3-benzothiazol-2-yl]-2-methylpropanamide IUPAC Name: N-[5-[3-(4-methoxyphenyl)propanoylamino]-1,3-benzothiazol-2-yl]-2-methylpropanamide Traditional Name: N-[5-[3-(4-methoxyphenyl)propanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O3S/c1-13(2)20(26)24-21-23-17-12-15(7-10-18(17)28-21)22-19(25)11-6-14-4-8-16(27-3)9-5-14/h4-5,7-10,12-13H,6,11H2,1-3H3,(H,22,25)(H,23,24,26)