N-[2-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxy-N-(phenylmethyl)propanamide

Systemtic Name: N-[2-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxy-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxy-propanamide CAS Name: N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxy-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-N-[2-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxypropanamide Traditional Name: N-benzyl-N-[2-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethylamino]ethyl]-3-phenethyloxy-propionamide Formula: C29H33N3O4S MolecularWeight: 519.65502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOCCC(=O)N(CCNCCC2=C3C(=C(C=C2)O)NC(=O)S3)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCOCCC(=O)N(CCNCCC2=C3C(=C(C=C2)O)NC(=O)S3)CC4=CC=CC=C4

InChI

InChI=1S/C29H33N3O4S/c33-25-12-11-24(28-27(25)31-29(35)37-28)13-16-30-17-18-32(21-23-9-5-2-6-10-23)26(34)15-20-36-19-14-22-7-3-1-4-8-22/h1-12,30,33H,13-21H2,(H,31,35)