3-[1-[2-[phenyl(thiophen-3-yl)amino]ethyl]piperidin-4-yl]quinazolin-4-one

Systemtic Name: 3-[1-[2-[phenyl(thiophen-3-yl)amino]ethyl]piperidin-4-yl]quinazolin-4-one Openeye Name: 3-[1-[2-[N-(3-thienyl)anilino]ethyl]-4-piperidyl]quinazolin-4-one CAS Name: 3-[1-[2-[N-(3-thiophenyl)anilino]ethyl]-4-piperidinyl]-4-quinazolinone IUPAC Name: 3-[1-[2-(N-thiophen-3-ylanilino)ethyl]piperidin-4-yl]quinazolin-4-one Traditional Name: 3-[1-[2-[N-(3-thienyl)anilino]ethyl]-4-piperidyl]quinazolin-4-one Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=CC=CC=C3C2=O)CCN(C4=CC=CC=C4)C5=CSC=C5

Isomeric SMILES

C1CN(CCC1N2C=NC3=CC=CC=C3C2=O)CCN(C4=CC=CC=C4)C5=CSC=C5

InChI

InChI=1S/C25H26N4OS/c30-25-23-8-4-5-9-24(23)26-19-29(25)21-10-13-27(14-11-21)15-16-28(22-12-17-31-18-22)20-6-2-1-3-7-20/h1-9,12,17-19,21H,10-11,13-16H2