2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(2-furylmethylcarbamoylamino)phenyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[4-[[(2-furanylmethylamino)-oxomethyl]amino]phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[4-(2-furfurylcarbamoylamino)phenyl]acetamide Formula: C21H18N4O3S2 MolecularWeight: 438.52262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)NC(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H18N4O3S2/c26-19(13-29-21-25-17-5-1-2-6-18(17)30-21)23-14-7-9-15(10-8-14)24-20(27)22-12-16-4-3-11-28-16/h1-11H,12-13H2,(H,23,26)(H2,22,24,27)