N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]cyclobutanecarboxamide

Systemtic Name: N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]cyclobutanecarboxamide Openeye Name: N-[[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]carbamothioyl]cyclobutanecarboxamide CAS Name: N-[[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-sulfanylidenemethyl]cyclobutanecarboxamide IUPAC Name: N-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamothioyl]cyclobutanecarboxamide Traditional Name: N-[[4-(4-methylpiperidino)sulfonylphenyl]thiocarbamoyl]cyclobutanecarboxamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3CCC3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3CCC3

InChI

InChI=1S/C18H25N3O3S2/c1-13-9-11-21(12-10-13)26(23,24)16-7-5-15(6-8-16)19-18(25)20-17(22)14-3-2-4-14/h5-8,13-14H,2-4,9-12H2,1H3,(H2,19,20,22,25)