2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1-cyclopropyl-5-tetrazolyl)methylthio]-3-prop-2-enyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(1-cyclopropyltetrazol-5-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(1-cyclopropyltetrazol-5-yl)methylthio]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C18H16N6OS3 MolecularWeight: 428.55424

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC3=NN=NN3C4CC4)SC=C2C5=CC=CS5

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC3=NN=NN3C4CC4)SC=C2C5=CC=CS5

InChI

InChI=1S/C18H16N6OS3/c1-2-7-23-17(25)15-12(13-4-3-8-26-13)9-27-16(15)19-18(23)28-10-14-20-21-22-24(14)11-5-6-11/h2-4,8-9,11H,1,5-7,10H2