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

Systemtic Name: 5-azanyl-1-phenyl-3-[3-(thieno[2,3-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-phenyl-3-[3-(thieno[2,3-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-phenyl-3-[3-(4-thieno[2,3-d]pyrimidinylamino)propyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-phenyl-3-[3-(thieno[2,3-d]pyrimidin-4-ylamino)propyl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-phenyl-3-[3-(thieno[2,3-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=C4C=CSC4=NC=N3)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC3=C4C=CSC4=NC=N3)C#N)N

InChI

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