4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-amino]-N-pyridin-4-yl-butanamide

Systemtic Name: 4-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonyl-methyl-amino]-N-pyridin-4-yl-butanamide Openeye Name: 4-[(9,10-dioxo-2-anthryl)sulfonyl-methyl-amino]-N-(4-pyridyl)butanamide CAS Name: 4-[(9,10-dioxo-2-anthracenyl)sulfonyl-methylamino]-N-pyridin-4-ylbutanamide IUPAC Name: 4-[(9,10-dioxoanthracen-2-yl)sulfonyl-methylamino]-N-pyridin-4-ylbutanamide Traditional Name: 4-[(9,10-diketo-2-anthryl)sulfonyl-methyl-amino]-N-(4-pyridyl)butyramide Formula: C24H21N3O5S MolecularWeight: 463.50564

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NC1=CC=NC=C1)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN(CCCC(=O)NC1=CC=NC=C1)S(=O)(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H21N3O5S/c1-27(14-4-7-22(28)26-16-10-12-25-13-11-16)33(31,32)17-8-9-20-21(15-17)24(30)19-6-3-2-5-18(19)23(20)29/h2-3,5-6,8-13,15H,4,7,14H2,1H3,(H,25,26,28)