N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: 3-(2-ketochromen-3-yl)-N-[2-(4-mesylpiperazino)phenyl]benzamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=CC(=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C27H25N3O5S/c1-36(33,34)30-15-13-29(14-16-30)24-11-4-3-10-23(24)28-26(31)21-9-6-8-19(17-21)22-18-20-7-2-5-12-25(20)35-27(22)32/h2-12,17-18H,13-16H2,1H3,(H,28,31)