3-azanyl-5-[3-[methyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[methyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[methyl-[2-(2-thienyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[methyl-(2-thiophen-2-yl-4-quinazolinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[methyl-(2-thiophen-2-ylquinazolin-4-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[methyl-[2-(2-thienyl)quinazolin-4-yl]amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C20H19N7S MolecularWeight: 389.47676

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CN(CCCC1=C(C(=NN1)N)C#N)C2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C20H19N7S/c1-27(10-4-8-16-14(12-21)18(22)26-25-16)20-13-6-2-3-7-15(13)23-19(24-20)17-9-5-11-28-17/h2-3,5-7,9,11H,4,8,10H2,1H3,(H3,22,25,26)