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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-chloranyl-N-(2-methylpropyl)-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-chloro-N-isobutyl-5-morpholinosulfonyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-chloro-N-(2-methylpropyl)-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-chloro-N-(2-methylpropyl)-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-chloro-N-isobutyl-5-morpholinosulfonyl-benzamide Formula: C23H32ClN5O6S MolecularWeight: 542.04808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl)N

InChI

InChI=1S/C23H32ClN5O6S/c1-4-5-8-28-20(25)19(21(30)26-23(28)32)29(14-15(2)3)22(31)17-13-16(6-7-18(17)24)36(33,34)27-9-11-35-12-10-27/h6-7,13,15H,4-5,8-12,14,25H2,1-3H3,(H,26,30,32)