N-[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]butanamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]butanamide Openeye Name: N-[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]butanamide CAS Name: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]butanamide IUPAC Name: N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]butanamide Traditional Name: N-[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]butyramide Formula: C18H18N2OS MolecularWeight: 310.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H18N2OS/c1-3-6-17(21)19-15-11-13(10-9-12(15)2)18-20-14-7-4-5-8-16(14)22-18/h4-5,7-11H,3,6H2,1-2H3,(H,19,21)