N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-3-chloro-benzothiophene-2-carboxamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-3-chloro-benzothiophene-2-carboxamide Formula: C20H23ClN4O3S MolecularWeight: 434.93962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H23ClN4O3S/c1-3-5-11-24(15-17(22)25(10-4-2)20(28)23-18(15)26)19(27)16-14(21)12-8-6-7-9-13(12)29-16/h6-9H,3-5,10-11,22H2,1-2H3,(H,23,26,28)