N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thiophene-2-carboxamide CAS Name: N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]thiophene-2-carboxamide Formula: C24H24N6O2S MolecularWeight: 460.55136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)[C@@H](CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

InChI

InChI=1S/C24H24N6O2S/c31-22(21-7-3-14-33-21)28-20(15-17-16-27-19-6-2-1-5-18(17)19)23(32)29-10-12-30(13-11-29)24-25-8-4-9-26-24/h1-9,14,16,20,27H,10-13,15H2,(H,28,31)/t20-/m1/s1