N-(2-methoxyethyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(phenylmethyl)benzamide

Systemtic Name: N-(2-methoxyethyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(2-methoxyethyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-methoxyethyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(2-methoxyethyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-benzyl-3-(3-ketopiperazino)sulfonyl-N-(2-methoxyethyl)benzamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

COCCN(CC1=CC=CC=C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C21H25N3O5S/c1-29-13-12-23(15-17-6-3-2-4-7-17)21(26)18-8-5-9-19(14-18)30(27,28)24-11-10-22-20(25)16-24/h2-9,14H,10-13,15-16H2,1H3,(H,22,25)