1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[3-(2-furyl)-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[3-(2-furanyl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-phenyl-1-propanone IUPAC Name: 1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[3-(2-furyl)-5-(2-thenylamino)-1,2,4-triazol-1-yl]-3-phenyl-propan-1-one Formula: C20H18N4O2S MolecularWeight: 378.44752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N2C(=NC(=N2)C3=CC=CO3)NCC4=CC=CS4

InChI

InChI=1S/C20H18N4O2S/c25-18(11-10-15-6-2-1-3-7-15)24-20(21-14-16-8-5-13-27-16)22-19(23-24)17-9-4-12-26-17/h1-9,12-13H,10-11,14H2,(H,21,22,23)