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

Systemtic Name: 1-(2-acetamidoethyl)-2-methyl-5-[2-(phenoxymethyl)-1,3-thiazol-4-yl]pyrrole-3-carboxamide Openeye Name: 1-(2-acetamidoethyl)-2-methyl-5-[2-(phenoxymethyl)thiazol-4-yl]pyrrole-3-carboxamide CAS Name: 1-(2-acetamidoethyl)-2-methyl-5-[2-(phenoxymethyl)-4-thiazolyl]-3-pyrrolecarboxamide IUPAC Name: 1-(2-acetamidoethyl)-2-methyl-5-[2-(phenoxymethyl)-1,3-thiazol-4-yl]pyrrole-3-carboxamide Traditional Name: 1-(2-acetamidoethyl)-2-methyl-5-[2-(phenoxymethyl)thiazol-4-yl]pyrrole-3-carboxamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3S/c1-13-16(20(21)26)10-18(24(13)9-8-22-14(2)25)17-12-28-19(23-17)11-27-15-6-4-3-5-7-15/h3-7,10,12H,8-9,11H2,1-2H3,(H2,21,26)(H,22,25)