N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3-(1H-indol-3-yl)propanamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-tert-butyl-pyrazol-3-yl]-3-(1H-indol-3-yl)propanamide Openeye Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-(1H-indol-3-yl)propanamide CAS Name: N-[5-tert-butyl-2-(1,1-dioxo-3-thiolanyl)-3-pyrazolyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: N-[5-tert-butyl-2-(1,1-dioxothiolan-3-yl)pyrazol-3-yl]-3-(1H-indol-3-yl)propanamide Traditional Name: N-[5-tert-butyl-2-(1,1-diketothiolan-3-yl)pyrazol-3-yl]-3-(1H-indol-3-yl)propionamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCC2=CNC3=CC=CC=C32)C4CCS(=O)(=O)C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCC2=CNC3=CC=CC=C32)C4CCS(=O)(=O)C4

InChI

InChI=1S/C22H28N4O3S/c1-22(2,3)19-12-20(26(25-19)16-10-11-30(28,29)14-16)24-21(27)9-8-15-13-23-18-7-5-4-6-17(15)18/h4-7,12-13,16,23H,8-11,14H2,1-3H3,(H,24,27)