N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(2,4-dioxo-1-pyrimidinyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(2,4-dioxopyrimidin-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2,4-diketopyrimidin-1-yl)acetamide Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C=CC(=O)NC2=O)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C=CC(=O)NC2=O)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H24N4O5S/c1-14-6-7-15(20-18(25)13-22-11-8-17(24)21-19(22)26)12-16(14)29(27,28)23-9-4-2-3-5-10-23/h6-8,11-12H,2-5,9-10,13H2,1H3,(H,20,25)(H,21,24,26)