N-[4-[[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbamothioylamino]phenyl]-N-methyl-ethanamide

Systemtic Name: N-[4-[[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbamothioylamino]phenyl]-N-methyl-ethanamide Openeye Name: N-[4-[[4-[(2-ethyl-1-piperidyl)sulfonyl]phenyl]carbamothioylamino]phenyl]-N-methyl-acetamide CAS Name: N-[4-[[[4-[(2-ethyl-1-piperidinyl)sulfonyl]anilino]-sulfanylidenemethyl]amino]phenyl]-N-methylacetamide IUPAC Name: N-[4-[[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbamothioylamino]phenyl]-N-methylacetamide Traditional Name: N-[4-[[4-(2-ethylpiperidino)sulfonylphenyl]thiocarbamoylamino]phenyl]-N-methyl-acetamide Formula: C23H30N4O3S2 MolecularWeight: 474.6393

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)N(C)C(=O)C

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)N(C)C(=O)C

InChI

InChI=1S/C23H30N4O3S2/c1-4-20-7-5-6-16-27(20)32(29,30)22-14-10-19(11-15-22)25-23(31)24-18-8-12-21(13-9-18)26(3)17(2)28/h8-15,20H,4-7,16H2,1-3H3,(H2,24,25,31)