1-methyl-4-[4-(3-oxidanylidene-3-phenylazanyl-propyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-(3-oxidanylidene-3-phenylazanyl-propyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 4-[4-(3-anilino-3-oxo-propyl)piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-(3-anilino-3-oxopropyl)-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-(3-anilino-3-oxopropyl)piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-(3-anilino-3-keto-propyl)piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C19H25N5O4S MolecularWeight: 419.4979

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)CCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H25N5O4S/c1-22-14-16(13-17(22)19(20)26)29(27,28)24-11-9-23(10-12-24)8-7-18(25)21-15-5-3-2-4-6-15/h2-6,13-14H,7-12H2,1H3,(H2,20,26)(H,21,25)