1-[(4-azanylquinazolin-7-yl)methyl]-4-[2-(5-chloranylthiophen-2-yl)oxyethanoyl]-3-methoxy-3-methyl-piperazin-2-one

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[2-(5-chloranylthiophen-2-yl)oxyethanoyl]-3-methoxy-3-methyl-piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-[(5-chloro-2-thienyl)oxy]acetyl]-3-methoxy-3-methyl-piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[2-[(5-chloro-2-thiophenyl)oxy]-1-oxoethyl]-3-methoxy-3-methyl-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-(5-chlorothiophen-2-yl)oxyacetyl]-3-methoxy-3-methylpiperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[2-[(5-chloro-2-thienyl)oxy]acetyl]-3-methoxy-3-methyl-piperazin-2-one Formula: C21H22ClN5O4S MolecularWeight: 475.94848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(CCN1C(=O)COC2=CC=C(S2)Cl)CC3=CC4=C(C=C3)C(=NC=N4)N)OC

Isomeric SMILES

CC1(C(=O)N(CCN1C(=O)COC2=CC=C(S2)Cl)CC3=CC4=C(C=C3)C(=NC=N4)N)OC

InChI

InChI=1S/C21H22ClN5O4S/c1-21(30-2)20(29)26(10-13-3-4-14-15(9-13)24-12-25-19(14)23)7-8-27(21)17(28)11-31-18-6-5-16(22)32-18/h3-6,9,12H,7-8,10-11H2,1-2H3,(H2,23,24,25)