ethyl 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperazin-1-yl]acetate CAS Name: 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperazin-1-yl]acetate Traditional Name: 2-[4-[(2-phenyl-3H-benzimidazol-5-yl)sulfonyl]piperazino]acetic acid ethyl ester Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O4S/c1-2-29-20(26)15-24-10-12-25(13-11-24)30(27,28)17-8-9-18-19(14-17)23-21(22-18)16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3,(H,22,23)