N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butyramide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NC1=CC=CC=C1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(CCCC(=O)NC1=CC=CC=C1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H25N3O4S2/c1-28(34(30,31)19-15-13-18(32-2)14-16-19)17-7-12-24(29)26-21-9-4-3-8-20(21)25-27-22-10-5-6-11-23(22)33-25/h3-6,8-11,13-16H,7,12,17H2,1-2H3,(H,26,29)