N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-3-[4-(2-pyrazinyl)-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-3-(4-pyrazin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-3-(4-pyrazin-2-ylpiperazino)propionamide Formula: C21H27ClN6O3S MolecularWeight: 478.99548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CCN3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CCN3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C21H27ClN6O3S/c22-18-4-3-17(32(30,31)28-8-1-2-9-28)15-19(18)25-21(29)5-10-26-11-13-27(14-12-26)20-16-23-6-7-24-20/h3-4,6-7,15-16H,1-2,5,8-14H2,(H,25,29)