(phenylmethyl) N-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-3-butanoyl-piperazin-1-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-3-butanoyl-piperazin-1-yl]carbamate Openeye Name: benzyl N-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-3-butanoyl-piperazin-1-yl]carbamate CAS Name: N-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-3-(1-oxobutyl)-1-piperazinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-3-butanoylpiperazin-1-yl]carbamate Traditional Name: N-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-3-butyryl-piperazino]carbamic acid benzyl ester Formula: C26H32N6O5 MolecularWeight: 508.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1CN(CCN1C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(=O)C1CN(CCN1C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H32N6O5/c1-4-8-21(33)20-15-31(30-26(34)37-16-17-9-6-5-7-10-17)11-12-32(20)25-28-19-14-23(36-3)22(35-2)13-18(19)24(27)29-25/h5-7,9-10,13-14,20H,4,8,11-12,15-16H2,1-3H3,(H,30,34)(H2,27,28,29)