N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-[4-[[(cyclopropylamino)-oxomethyl]amino]phenyl]-1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC=C(C=C2)NC(=O)NC3CC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC=C(C=C2)NC(=O)NC3CC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H27N5O4S/c1-25-14-18(31(29,30)26-11-3-2-4-12-26)13-19(25)20(27)22-15-5-7-16(8-6-15)23-21(28)24-17-9-10-17/h5-8,13-14,17H,2-4,9-12H2,1H3,(H,22,27)(H2,23,24,28)