4-[4-[(2S)-2-[(2-chlorophenyl)carbonylamino]propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-[4-[(2S)-2-[(2-chlorophenyl)carbonylamino]propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[(2S)-2-[(2-chlorobenzoyl)amino]propanoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[(2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]-1-oxopropyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[(2S)-2-[(2-chlorobenzoyl)amino]propanoyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[(2S)-2-[(2-chlorobenzoyl)amino]propanoyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C20H24ClN5O5S MolecularWeight: 481.95306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)N)C)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H24ClN5O5S/c1-13(23-19(28)15-5-3-4-6-16(15)21)20(29)25-7-9-26(10-8-25)32(30,31)14-11-17(18(22)27)24(2)12-14/h3-6,11-13H,7-10H2,1-2H3,(H2,22,27)(H,23,28)/t13-/m0/s1