5-azanyl-1-phenyl-3-[3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-phenyl-3-[3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-phenyl-3-[3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-phenyl-3-[3-(4-thieno[3,2-d]pyrimidinylamino)propyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-phenyl-3-[3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-phenyl-3-[3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile Formula: C19H17N7S MolecularWeight: 375.45018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC3=NC=NC4=C3SC=C4)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC3=NC=NC4=C3SC=C4)C#N)N

InChI

InChI=1S/C19H17N7S/c20-11-14-15(25-26(18(14)21)13-5-2-1-3-6-13)7-4-9-22-19-17-16(8-10-27-17)23-12-24-19/h1-3,5-6,8,10,12H,4,7,9,21H2,(H,22,23,24)