(E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-methyl-3-thiophen-2-yl-prop-2-en-1-one hydrochloride

Systemtic Name: (E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-methyl-3-thiophen-2-yl-prop-2-en-1-one hydrochloride Openeye Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-methyl-3-(2-thienyl)prop-2-en-1-one hydrochloride CAS Name: (E)-1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-2-methyl-3-thiophen-2-yl-2-propen-1-one hydrochloride IUPAC Name: (E)-1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-2-methyl-3-thiophen-2-ylprop-2-en-1-one hydrochloride Traditional Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-2-methyl-3-(2-thienyl)prop-2-en-1-one hydrochloride Formula: C22H26ClN5O3S MolecularWeight: 475.99154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CS1)C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.Cl

Isomeric SMILES

C/C(=C\C1=CC=CS1)/C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC.Cl

InChI

InChI=1S/C22H25N5O3S.ClH/c1-14(11-15-5-4-10-31-15)21(28)26-6-8-27(9-7-26)22-24-17-13-19(30-3)18(29-2)12-16(17)20(23)25-22;/h4-5,10-13H,6-9H2,1-3H3,(H2,23,24,25);1H/b14-11+;