2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(butylaminomethyl)-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1

Isomeric SMILES

CCCCNCC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1

InChI

InChI=1S/C17H19N3OS/c1-2-3-9-18-11-15-19-16(21)13-10-14(22-17(13)20-15)12-7-5-4-6-8-12/h4-8,10,18H,2-3,9,11H2,1H3,(H,19,20,21)