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

Systemtic Name: 3-azanyl-5-[3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylamino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]propyl]-1H-pyrazole-4-carbonitrile Formula: C19H18N6OS MolecularWeight: 378.45082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)CNCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)CNCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C19H18N6OS/c20-10-13-14(24-25-18(13)21)5-3-9-22-11-12-7-8-16(26-12)19-23-15-4-1-2-6-17(15)27-19/h1-2,4,6-8,22H,3,5,9,11H2,(H3,21,24,25)