N-[3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-3-oxidanylidene-propyl]-4-chloranyl-benzamide

Systemtic Name: N-[3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-3-oxidanylidene-propyl]-4-chloranyl-benzamide Openeye Name: N-[3-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]-3-oxo-propyl]-4-chloro-benzamide CAS Name: N-[3-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-ethylamino]-3-oxopropyl]-4-chlorobenzamide IUPAC Name: N-[3-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-3-oxopropyl]-4-chlorobenzamide Traditional Name: N-[3-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]-3-keto-propyl]-4-chloro-benzamide Formula: C20H26ClN5O4 MolecularWeight: 435.90454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CCNC(=O)C2=CC=C(C=C2)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)CCNC(=O)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C20H26ClN5O4/c1-3-5-12-26-17(22)16(19(29)24-20(26)30)25(4-2)15(27)10-11-23-18(28)13-6-8-14(21)9-7-13/h6-9H,3-5,10-12,22H2,1-2H3,(H,23,28)(H,24,29,30)