N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: 4-benzylsulfonyl-N-[4-(4-ethoxyphenyl)thiazol-2-yl]butanamide CAS Name: N-[4-(4-ethoxyphenyl)-2-thiazolyl]-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: 4-benzylsulfonyl-N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-benzylsulfonyl-N-(4-p-phenetylthiazol-2-yl)butyramide Formula: C22H24N2O4S2 MolecularWeight: 444.56696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4S2/c1-2-28-19-12-10-18(11-13-19)20-15-29-22(23-20)24-21(25)9-6-14-30(26,27)16-17-7-4-3-5-8-17/h3-5,7-8,10-13,15H,2,6,9,14,16H2,1H3,(H,23,24,25)