2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-N-(4-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-N-(4-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]-N-(4-methylsulfanylphenyl)acetamide CAS Name: 2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-ethylamino]-N-[4-(methylthio)phenyl]acetamide IUPAC Name: 2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-N-(4-methylsulfanylphenyl)acetamide Traditional Name: 2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]-N-[4-(methylthio)phenyl]acetamide Formula: C19H27N5O3S MolecularWeight: 405.51438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC(=O)NC2=CC=C(C=C2)SC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC(=O)NC2=CC=C(C=C2)SC)N

InChI

InChI=1S/C19H27N5O3S/c1-4-6-11-24-17(20)16(18(26)22-19(24)27)23(5-2)12-15(25)21-13-7-9-14(28-3)10-8-13/h7-10H,4-6,11-12,20H2,1-3H3,(H,21,25)(H,22,26,27)