3-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(1-butyl-1,2,3,4-tetrazol-5-yl)methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(1-butyltetrazol-5-yl)methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(1-butyl-5-tetrazolyl)methyl]-6-ethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(1-butyltetrazol-5-yl)methyl]-6-ethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(1-butyltetrazol-5-yl)methyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C14H18N6OS MolecularWeight: 318.39732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CN2C=NC3=C(C2=O)C=C(S3)CC

Isomeric SMILES

CCCCN1C(=NN=N1)CN2C=NC3=C(C2=O)C=C(S3)CC

InChI

InChI=1S/C14H18N6OS/c1-3-5-6-20-12(16-17-18-20)8-19-9-15-13-11(14(19)21)7-10(4-2)22-13/h7,9H,3-6,8H2,1-2H3