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

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(4-propylphenoxy)butanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(4-propylphenoxy)butanamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(4-propylphenoxy)butanamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(4-propylphenoxy)butanamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(4-propylphenoxy)butyramide Formula: C27H28N2O2S MolecularWeight: 444.58842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCCC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCCC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C27H28N2O2S/c1-3-5-20-8-14-23(15-9-20)31-17-4-6-26(30)28-22-12-10-21(11-13-22)27-29-24-16-7-19(2)18-25(24)32-27/h7-16,18H,3-6,17H2,1-2H3,(H,28,30)