[4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]-(4-ethylphenyl)methanone

Systemtic Name: [4-[5-(1,3-benzothiazol-2-yl)furan-2-yl]carbonylpiperazin-1-yl]-(4-ethylphenyl)methanone Openeye Name: [4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone CAS Name: [4-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]-oxomethyl]-1-piperazinyl]-(4-ethylphenyl)methanone IUPAC Name: [4-[5-(1,3-benzothiazol-2-yl)furan-2-carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone Traditional Name: [4-[5-(1,3-benzothiazol-2-yl)-2-furoyl]piperazino]-(4-ethylphenyl)methanone Formula: C25H23N3O3S MolecularWeight: 445.53342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H23N3O3S/c1-2-17-7-9-18(10-8-17)24(29)27-13-15-28(16-14-27)25(30)21-12-11-20(31-21)23-26-19-5-3-4-6-22(19)32-23/h3-12H,2,13-16H2,1H3