2-[(4-but-2-ynoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-N-oxidanyl-butanamide

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-N-oxidanyl-butanamide Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-butanehydroxamic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-(3-pyridinylmethyl)amino]-N-hydroxy-3-methylbutanamide IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-N-hydroxy-3-methylbutanamide Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-butanehydroxamic acid Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CN=CC=C2)C(C(C)C)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CN=CC=C2)C(C(C)C)C(=O)NO

InChI

InChI=1S/C21H25N3O5S/c1-4-5-13-29-18-8-10-19(11-9-18)30(27,28)24(15-17-7-6-12-22-14-17)20(16(2)3)21(25)23-26/h6-12,14,16,20,26H,13,15H2,1-3H3,(H,23,25)