N-[4-(2-hydroxyphenyl)piperazin-1-yl]carbothioyl-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2-hydroxyphenyl)piperazin-1-yl]carbothioyl-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(2-hydroxyphenyl)piperazine-1-carbothioyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[[4-(2-hydroxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(2-hydroxyphenyl)piperazine-1-carbothioyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(2-hydroxyphenyl)piperazine-1-carbothioyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C23H28N4O5S2 MolecularWeight: 504.62222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)N3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)N3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C23H28N4O5S2/c1-17-6-7-18(34(30,31)27-12-14-32-15-13-27)16-19(17)22(29)24-23(33)26-10-8-25(9-11-26)20-4-2-3-5-21(20)28/h2-7,16,28H,8-15H2,1H3,(H,24,29,33)