N-[[4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[4-[(2-azanyl-2-oxidanylidene-ethyl)carbamoyl]phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[4-[(2-amino-2-oxo-ethyl)carbamoyl]phenyl]methyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[[4-[[(2-amino-2-oxoethyl)amino]-oxomethyl]phenyl]methyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[4-[(2-amino-2-oxoethyl)carbamoyl]phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-[(2-amino-2-keto-ethyl)carbamoyl]benzyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC=C(C=C3)C(=O)NCC(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC=C(C=C3)C(=O)NCC(=O)N

InChI

InChI=1S/C23H28N4O5S/c1-16-5-10-19(33(31,32)27-11-3-2-4-12-27)13-20(16)23(30)25-14-17-6-8-18(9-7-17)22(29)26-15-21(24)28/h5-10,13H,2-4,11-12,14-15H2,1H3,(H2,24,28)(H,25,30)(H,26,29)