1-(2-acetamidoethyl)-5-[2-[(3-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 1-(2-acetamidoethyl)-5-[2-[(3-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Openeye Name: 1-(2-acetamidoethyl)-5-[2-[(3-chlorophenoxy)methyl]thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide CAS Name: 1-(2-acetamidoethyl)-5-[2-[(3-chlorophenoxy)methyl]-4-thiazolyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: 1-(2-acetamidoethyl)-5-[2-[(3-chlorophenoxy)methyl]-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxamide Traditional Name: 1-(2-acetamidoethyl)-5-[2-[(3-chlorophenoxy)methyl]thiazol-4-yl]-2-methyl-pyrrole-3-carboxamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCNC(=O)C)C2=CSC(=N2)COC3=CC(=CC=C3)Cl)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CCNC(=O)C)C2=CSC(=N2)COC3=CC(=CC=C3)Cl)C(=O)N

InChI

InChI=1S/C20H21ClN4O3S/c1-12-16(20(22)27)9-18(25(12)7-6-23-13(2)26)17-11-29-19(24-17)10-28-15-5-3-4-14(21)8-15/h3-5,8-9,11H,6-7,10H2,1-2H3,(H2,22,27)(H,23,26)