3-azanyl-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]furan-2-yl]-4,5-dihydro-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]furan-2-yl]-4,5-dihydro-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]-2-furyl]-4,5-dihydro-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]-2-furanyl]-4,5-dihydro-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]furan-2-yl]-4,5-dihydro-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[5-[4-(1,3-benzothiazol-2-yl)phenyl]-2-furyl]-2-pyrazoline-4-carbonitrile Formula: C21H15N5OS MolecularWeight: 385.4417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)C4=CC=C(O4)C5C(C(=NN5)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)C4=CC=C(O4)C5C(C(=NN5)N)C#N

InChI

InChI=1S/C21H15N5OS/c22-11-14-19(25-26-20(14)23)17-10-9-16(27-17)12-5-7-13(8-6-12)21-24-15-3-1-2-4-18(15)28-21/h1-10,14,19,25H,(H2,23,26)