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

Systemtic Name: 5-azanyl-3-[[4-(1,3-benzothiazol-2-yl)phenyl]amino]-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[4-(1,3-benzothiazol-2-yl)anilino]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[4-(1,3-benzothiazol-2-yl)anilino]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[4-(1,3-benzothiazol-2-yl)anilino]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[4-(1,3-benzothiazol-2-yl)anilino]-1H-pyrazole-4-carbonitrile Formula: C17H12N6S MolecularWeight: 332.38238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC4=NNC(=C4C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC4=NNC(=C4C#N)N

InChI

InChI=1S/C17H12N6S/c18-9-12-15(19)22-23-16(12)20-11-7-5-10(6-8-11)17-21-13-3-1-2-4-14(13)24-17/h1-8H,(H4,19,20,22,23)