N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-chloranyl-N-(2-methoxyethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-chloranyl-N-(2-methoxyethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-chloro-N-(2-methoxyethyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-chloro-N-(2-methoxyethyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-chloro-N-(2-methoxyethyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-4-chloro-N-(2-methoxyethyl)-3-pyrrolidinosulfonyl-benzamide Formula: C22H30ClN5O6S MolecularWeight: 528.0215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)N

InChI

InChI=1S/C22H30ClN5O6S/c1-3-4-11-28-19(24)18(20(29)25-22(28)31)27(12-13-34-2)21(30)15-7-8-16(23)17(14-15)35(32,33)26-9-5-6-10-26/h7-8,14H,3-6,9-13,24H2,1-2H3,(H,25,29,31)