N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-bromophenyl)sulfanyl-N-(2-methoxyethyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-bromophenyl)sulfanyl-N-(2-methoxyethyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-(2-methoxyethyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-[(4-bromophenyl)thio]-N-(2-methoxyethyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-(2-methoxyethyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-[(4-bromophenyl)thio]-N-(2-methoxyethyl)acetamide Formula: C19H25BrN4O4S MolecularWeight: 485.3952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)CSC2=CC=C(C=C2)Br)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)CSC2=CC=C(C=C2)Br)N

InChI

InChI=1S/C19H25BrN4O4S/c1-3-4-9-24-17(21)16(18(26)22-19(24)27)23(10-11-28-2)15(25)12-29-14-7-5-13(20)6-8-14/h5-8H,3-4,9-12,21H2,1-2H3,(H,22,26,27)