N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-methylpropyl)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-methylpropyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-[(4-methyl-1-piperidinyl)sulfonyl]-N-(2-methylpropyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-(4-methylpiperidin-1-yl)sulfonyl-N-(2-methylpropyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C25H37N5O5S MolecularWeight: 519.65678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C)N

InChI

InChI=1S/C25H37N5O5S/c1-5-6-13-29-22(26)21(23(31)27-25(29)33)30(16-17(2)3)24(32)19-7-9-20(10-8-19)36(34,35)28-14-11-18(4)12-15-28/h7-10,17-18H,5-6,11-16,26H2,1-4H3,(H,27,31,33)