5-azanyl-2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 5-azanyl-2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 5-amino-2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]benzonitrile CAS Name: 5-amino-2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]benzonitrile IUPAC Name: 5-amino-2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]benzonitrile Traditional Name: 5-amino-2-[4-(1,2-benzothiazol-3-yl)piperazino]benzonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)N)C#N)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)N)C#N)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C18H17N5S/c19-12-13-11-14(20)5-6-16(13)22-7-9-23(10-8-22)18-15-3-1-2-4-17(15)24-21-18/h1-6,11H,7-10,20H2