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

Systemtic Name: 3-acetamido-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-3-(2-thienyl)propionamide Formula: C20H29N5O4S MolecularWeight: 435.54036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CC(C2=CC=CS2)NC(=O)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CC(C2=CC=CS2)NC(=O)C

InChI

InChI=1S/C20H29N5O4S/c1-4-6-10-24(17-18(21)25(9-5-2)20(29)23-19(17)28)16(27)12-14(22-13(3)26)15-8-7-11-30-15/h7-8,11,14H,4-6,9-10,12,21H2,1-3H3,(H,22,26)(H,23,28,29)