[4-(3-methoxyphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone

Systemtic Name: [4-(3-methoxyphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone Openeye Name: [4-(3-methoxyphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone CAS Name: [4-(3-methoxyphenyl)-1-piperazinyl]-[1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolyl]methanone IUPAC Name: [4-(3-methoxyphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonylpyrrol-2-yl)methanone Traditional Name: [4-(3-methoxyphenyl)piperazino]-(1-methyl-4-pyrrolidinosulfonyl-pyrrol-2-yl)methanone Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H28N4O4S/c1-22-16-19(30(27,28)25-8-3-4-9-25)15-20(22)21(26)24-12-10-23(11-13-24)17-6-5-7-18(14-17)29-2/h5-7,14-16H,3-4,8-13H2,1-2H3