5-azanyl-2-[3-[5-(piperidin-1-ylmethyl)thiophen-3-yl]oxypropylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-azanyl-2-[3-[5-(piperidin-1-ylmethyl)thiophen-3-yl]oxypropylamino]-1H-pyrimidin-6-one Openeye Name: 5-amino-2-[3-[[5-(1-piperidylmethyl)-3-thienyl]oxy]propylamino]-1H-pyrimidin-6-one CAS Name: 5-amino-2-[3-[[5-(1-piperidinylmethyl)-3-thiophenyl]oxy]propylamino]-1H-pyrimidin-6-one IUPAC Name: 5-amino-2-[3-[5-(piperidin-1-ylmethyl)thiophen-3-yl]oxypropylamino]-1H-pyrimidin-6-one Traditional Name: 5-amino-2-[3-[[5-(piperidinomethyl)-3-thienyl]oxy]propylamino]-1H-pyrimidin-6-one Formula: C17H25N5O2S MolecularWeight: 363.4777

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CS2)OCCCNC3=NC=C(C(=O)N3)N

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CS2)OCCCNC3=NC=C(C(=O)N3)N

InChI

InChI=1S/C17H25N5O2S/c18-15-10-20-17(21-16(15)23)19-5-4-8-24-13-9-14(25-12-13)11-22-6-2-1-3-7-22/h9-10,12H,1-8,11,18H2,(H2,19,20,21,23)