1-[(4-azanylquinazolin-7-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-6-methyl-piperazin-2-one

Systemtic Name: 1-[(4-azanylquinazolin-7-yl)methyl]-4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-6-methyl-piperazin-2-one Openeye Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-6-methyl-piperazin-2-one CAS Name: 1-[(4-amino-7-quinazolinyl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-6-methyl-2-piperazinone IUPAC Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-6-methylpiperazin-2-one Traditional Name: 1-[(4-aminoquinazolin-7-yl)methyl]-4-(6-chlorobenzothiophen-2-yl)sulfonyl-6-methyl-piperazin-2-one Formula: C22H20ClN5O3S2 MolecularWeight: 502.0089

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1CC2=CC3=C(C=C2)C(=NC=N3)N)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

CC1CN(CC(=O)N1CC2=CC3=C(C=C2)C(=NC=N3)N)S(=O)(=O)C4=CC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C22H20ClN5O3S2/c1-13-9-27(33(30,31)21-7-15-3-4-16(23)8-19(15)32-21)11-20(29)28(13)10-14-2-5-17-18(6-14)25-12-26-22(17)24/h2-8,12-13H,9-11H2,1H3,(H2,24,25,26)