4-[6-methoxy-7-[2-oxidanyl-4-oxidanylidene-4-(2-oxidanylpyrrolidin-1-yl)butoxy]quinazolin-4-yl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-methoxy-7-[2-oxidanyl-4-oxidanylidene-4-(2-oxidanylpyrrolidin-1-yl)butoxy]quinazolin-4-yl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[7-[2-hydroxy-4-(2-hydroxypyrrolidin-1-yl)-4-oxo-butoxy]-6-methoxy-quinazolin-4-yl]-N-(4-isopropoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[7-[2-hydroxy-4-(2-hydroxy-1-pyrrolidinyl)-4-oxobutoxy]-6-methoxy-4-quinazolinyl]-N-(4-propan-2-yloxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-[2-hydroxy-4-(2-hydroxypyrrolidin-1-yl)-4-oxobutoxy]-6-methoxyquinazolin-4-yl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[7-[2-hydroxy-4-(2-hydroxypyrrolidino)-4-keto-butoxy]-6-methoxy-quinazolin-4-yl]-N-(4-isopropoxyphenyl)piperazine-1-carboxamide Formula: C31H40N6O7 MolecularWeight: 608.6853

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OCC(CC(=O)N5CCCC5O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OCC(CC(=O)N5CCCC5O)O

InChI

InChI=1S/C31H40N6O7/c1-20(2)44-23-8-6-21(7-9-23)34-31(41)36-13-11-35(12-14-36)30-24-16-26(42-3)27(17-25(24)32-19-33-30)43-18-22(38)15-29(40)37-10-4-5-28(37)39/h6-9,16-17,19-20,22,28,38-39H,4-5,10-15,18H2,1-3H3,(H,34,41)