N-[1-[2-oxidanylidene-2-(4-quinazolin-2-ylpiperazin-1-yl)ethyl]pyrazol-4-yl]thiophene-3-carboxamide

Systemtic Name: N-[1-[2-oxidanylidene-2-(4-quinazolin-2-ylpiperazin-1-yl)ethyl]pyrazol-4-yl]thiophene-3-carboxamide Openeye Name: N-[1-[2-oxo-2-(4-quinazolin-2-ylpiperazin-1-yl)ethyl]pyrazol-4-yl]thiophene-3-carboxamide CAS Name: N-[1-[2-oxo-2-[4-(2-quinazolinyl)-1-piperazinyl]ethyl]-4-pyrazolyl]-3-thiophenecarboxamide IUPAC Name: N-[1-[2-oxo-2-(4-quinazolin-2-ylpiperazin-1-yl)ethyl]pyrazol-4-yl]thiophene-3-carboxamide Traditional Name: N-[1-[2-keto-2-(4-quinazolin-2-ylpiperazino)ethyl]pyrazol-4-yl]thiophene-3-carboxamide Formula: C22H21N7O2S MolecularWeight: 447.51284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3C=N2)C(=O)CN4C=C(C=N4)NC(=O)C5=CSC=C5

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3C=N2)C(=O)CN4C=C(C=N4)NC(=O)C5=CSC=C5

InChI

InChI=1S/C22H21N7O2S/c30-20(14-29-13-18(12-24-29)25-21(31)17-5-10-32-15-17)27-6-8-28(9-7-27)22-23-11-16-3-1-2-4-19(16)26-22/h1-5,10-13,15H,6-9,14H2,(H,25,31)