2-chloranyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C27H26ClN5O4S MolecularWeight: 552.04444

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5)Cl

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C27H26ClN5O4S/c1-31(18-25-29-24-10-6-5-9-21(24)26(34)30-25)27(35)22-17-20(11-12-23(22)28)38(36,37)33-15-13-32(14-16-33)19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3,(H,29,30,34)