N-(furan-2-ylmethyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-[4-(2-nitrophenyl)-2-thiazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbothioamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])C(=S)NCC4=CC=CO4

InChI

InChI=1S/C20H20N4O3S2/c25-24(26)18-6-2-1-5-16(18)17-13-29-19(22-17)14-7-9-23(10-8-14)20(28)21-12-15-4-3-11-27-15/h1-6,11,13-14H,7-10,12H2,(H,21,28)