2-methyl-5-morpholin-4-ylsulfonyl-N-[(phenylmethyl)-pyridin-2-yl-carbamothioyl]benzamide

Systemtic Name: 2-methyl-5-morpholin-4-ylsulfonyl-N-[(phenylmethyl)-pyridin-2-yl-carbamothioyl]benzamide Openeye Name: N-[benzyl(2-pyridyl)carbamothioyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)-N-[[(phenylmethyl)-(2-pyridinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[benzyl(pyridin-2-yl)carbamothioyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[benzyl(2-pyridyl)thiocarbamoyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C25H26N4O4S2 MolecularWeight: 510.62834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)N(CC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)N(CC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C25H26N4O4S2/c1-19-10-11-21(35(31,32)28-13-15-33-16-14-28)17-22(19)24(30)27-25(34)29(23-9-5-6-12-26-23)18-20-7-3-2-4-8-20/h2-12,17H,13-16,18H2,1H3,(H,27,30,34)