N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)-N-(phenylmethyl)butanamide

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)butanamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)butanamide Traditional Name: N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenoxy)butyramide Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCOC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CCCOC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C27H28N2O3S/c1-19-11-16-24-26(20(19)2)28-27(33-24)29(18-21-8-5-4-6-9-21)25(30)10-7-17-32-23-14-12-22(31-3)13-15-23/h4-6,8-9,11-16H,7,10,17-18H2,1-3H3