2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfonyl-N-[4-(2-oxidanylidenepyrazin-1-yl)phenyl]butanamide

Systemtic Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfonyl-N-[4-(2-oxidanylidenepyrazin-1-yl)phenyl]butanamide Openeye Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfonyl-N-[4-(2-oxopyrazin-1-yl)phenyl]butanamide CAS Name: 2-[[(4-chloroanilino)-oxomethyl]amino]-4-methylsulfonyl-N-[4-(2-oxo-1-pyrazinyl)phenyl]butanamide IUPAC Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methylsulfonyl-N-[4-(2-oxopyrazin-1-yl)phenyl]butanamide Traditional Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[4-(2-ketopyrazin-1-yl)phenyl]-4-mesyl-butyramide Formula: C22H22ClN5O5S MolecularWeight: 503.95858

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC=C(C=C1)N2C=CN=CC2=O)NC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NC1=CC=C(C=C1)N2C=CN=CC2=O)NC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClN5O5S/c1-34(32,33)13-10-19(27-22(31)26-17-4-2-15(23)3-5-17)21(30)25-16-6-8-18(9-7-16)28-12-11-24-14-20(28)29/h2-9,11-12,14,19H,10,13H2,1H3,(H,25,30)(H2,26,27,31)