N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-[(2-methoxyphenyl)methyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-[(2-methoxyphenyl)methyl]-3-methylsulfanyl-propanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-[(2-methoxyphenyl)methyl]-3-methylsulfanyl-propanamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-[(2-methoxyphenyl)methyl]-3-(methylthio)propanamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-[(2-methoxyphenyl)methyl]-3-methylsulfanylpropanamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-(methylthio)-N-o-anisyl-propionamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2OC)C(=O)CCSC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2OC)C(=O)CCSC)N

InChI

InChI=1S/C20H28N4O4S/c1-4-5-11-23-18(21)17(19(26)22-20(23)27)24(16(25)10-12-29-3)13-14-8-6-7-9-15(14)28-2/h6-9H,4-5,10-13,21H2,1-3H3,(H,22,26,27)