4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-ethylthiophen-2-yl)piperazine-1-carboxamide

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-ethylthiophen-2-yl)piperazine-1-carboxamide Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-ethyl-2-thienyl)piperazine-1-carboxamide CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-N-(4-ethyl-2-thiophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-ethylthiophen-2-yl)piperazine-1-carboxamide Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-ethyl-2-thienyl)piperazine-1-carboxamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC

Isomeric SMILES

CCC1=CSC(=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC

InChI

InChI=1S/C21H25N5O3S/c1-4-14-9-19(30-12-14)24-21(27)26-7-5-25(6-8-26)20-15-10-17(28-2)18(29-3)11-16(15)22-13-23-20/h9-13H,4-8H2,1-3H3,(H,24,27)