N-(furan-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-tetralin-6-ylsulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-tetralin-6-ylsulfonyl-piperazine-1-carbothioamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C20H25N3O3S2/c24-28(25,19-8-7-16-4-1-2-5-17(16)14-19)23-11-9-22(10-12-23)20(27)21-15-18-6-3-13-26-18/h3,6-8,13-14H,1-2,4-5,9-12,15H2,(H,21,27)