N-[1-[4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]pyrazol-4-yl]furan-3-carboxamide

Systemtic Name: N-[1-[4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]pyrazol-4-yl]furan-3-carboxamide Openeye Name: N-[1-[4-[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]furan-3-carboxamide CAS Name: N-[1-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]-4-pyrazolyl]-3-furancarboxamide IUPAC Name: N-[1-[4-[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]furan-3-carboxamide Traditional Name: N-[1-[4-[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]-3-furamide Formula: C26H22N6O3S MolecularWeight: 498.55628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)N5C=C(C=N5)NC(=O)C6=COC=C6

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)N5C=C(C=N5)NC(=O)C6=COC=C6

InChI

InChI=1S/C26H22N6O3S/c33-24(19-9-14-35-17-19)28-20-15-27-32(16-20)21-7-5-18(6-8-21)25(34)30-10-12-31(13-11-30)26-29-22-3-1-2-4-23(22)36-26/h1-9,14-17H,10-13H2,(H,28,33)