[2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone Openeye Name: [2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-(2-thienyl)methanone CAS Name: [2-[[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-thiophen-2-ylmethanone Traditional Name: [2-[4-[(4-aminoquinazolin-2-yl)methyl]piperazine-1-carbonyl]phenyl]-(2-thienyl)methanone Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC=CC=C4C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C(=O)C4=CC=CC=C4C(=O)C5=CC=CS5

InChI

InChI=1S/C25H23N5O2S/c26-24-19-8-3-4-9-20(19)27-22(28-24)16-29-11-13-30(14-12-29)25(32)18-7-2-1-6-17(18)23(31)21-10-5-15-33-21/h1-10,15H,11-14,16H2,(H2,26,27,28)