1-(4-azanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-(4-azanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(4-imino-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)thiourea CAS Name: 1-(4-imino-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)-3-prop-2-enylthiourea IUPAC Name: 1-(4-imino-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(4-imino-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)thiourea Formula: C15H15N7S MolecularWeight: 325.3915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN1C=NC2=C(C1=N)C=NN2C3=CC=CC=C3

Isomeric SMILES

C=CCNC(=S)NN1C=NC2=C(C1=N)C=NN2C3=CC=CC=C3

InChI

InChI=1S/C15H15N7S/c1-2-8-17-15(23)20-21-10-18-14-12(13(21)16)9-19-22(14)11-6-4-3-5-7-11/h2-7,9-10,16H,1,8H2,(H2,17,20,23)