3-acetamido-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methylbutyl)-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(3-methylbutyl)-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isopentyl-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(3-methylbutyl)-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(3-methylbutyl)-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isoamyl-3-(2-thienyl)propionamide Formula: C22H33N5O4S MolecularWeight: 463.59352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CC(C2=CC=CS2)NC(=O)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC(C)C)C(=O)CC(C2=CC=CS2)NC(=O)C)N

InChI

InChI=1S/C22H33N5O4S/c1-5-6-10-27-20(23)19(21(30)25-22(27)31)26(11-9-14(2)3)18(29)13-16(24-15(4)28)17-8-7-12-32-17/h7-8,12,14,16H,5-6,9-11,13,23H2,1-4H3,(H,24,28)(H,25,30,31)