2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide Openeye Name: 2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]propanamide CAS Name: 2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]propanamide IUPAC Name: 2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]propanamide Traditional Name: 2-acetamido-3-(1H-indol-3-yl)-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]propionamide Formula: C21H22N6O2S MolecularWeight: 422.50338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C)C4=NC=CN4C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C)C4=NC=CN4C

InChI

InChI=1S/C21H22N6O2S/c1-12-18(19-22-8-9-27(19)3)30-21(24-12)26-20(29)17(25-13(2)28)10-14-11-23-16-7-5-4-6-15(14)16/h4-9,11,17,23H,10H2,1-3H3,(H,25,28)(H,24,26,29)