propan-2-yl 1-ethyl-4-[4-(1H-indol-3-yl)butanoylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[4-(1H-indol-3-yl)butanoylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[4-(1H-indol-3-yl)butanoylamino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[4-(1H-indol-3-yl)-1-oxobutyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[4-(1H-indol-3-yl)butanoylamino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-[4-(1H-indol-3-yl)butanoylamino]pyrazole-3-carboxylic acid isopropyl ester Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H26N4O3/c1-4-25-13-18(20(24-25)21(27)28-14(2)3)23-19(26)11-7-8-15-12-22-17-10-6-5-9-16(15)17/h5-6,9-10,12-14,22H,4,7-8,11H2,1-3H3,(H,23,26)