N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-[4-(4-acetamidophenyl)-2-thiazolyl]-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-[4-(4-acetamidophenyl)thiazol-2-yl]-3-[(4-methoxyphenyl)thio]propionamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21N3O3S2/c1-14(25)22-16-5-3-15(4-6-16)19-13-29-21(23-19)24-20(26)11-12-28-18-9-7-17(27-2)8-10-18/h3-10,13H,11-12H2,1-2H3,(H,22,25)(H,23,24,26)