(4-pyrimidin-2-ylpiperazin-1-yl)-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(3-pyrrolidin-1-ylsulfonyl-2-thienyl)methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-[3-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(3-pyrrolidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-(3-pyrrolidinosulfonyl-2-thienyl)methanone Formula: C17H21N5O3S2 MolecularWeight: 407.51034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(SC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C17H21N5O3S2/c23-16(20-9-11-21(12-10-20)17-18-5-3-6-19-17)15-14(4-13-26-15)27(24,25)22-7-1-2-8-22/h3-6,13H,1-2,7-12H2