N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]propanamide CAS Name: N-[4-(4-methoxyphenyl)-5-methyl-2-thiazolyl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]propanamide Traditional Name: 3-benzylsulfonyl-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]propionamide Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O4S2/c1-15-20(17-8-10-18(27-2)11-9-17)23-21(28-15)22-19(24)12-13-29(25,26)14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,22,23,24)