4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[(4-imidazol-1-ylphenyl)methyl]-3-propan-2-yl-piperazin-2-one

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[(4-imidazol-1-ylphenyl)methyl]-3-propan-2-yl-piperazin-2-one Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[(4-imidazol-1-ylphenyl)methyl]-3-isopropyl-piperazin-2-one CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[[4-(1-imidazolyl)phenyl]methyl]-3-propan-2-yl-2-piperazinone IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[(4-imidazol-1-ylphenyl)methyl]-3-propan-2-ylpiperazin-2-one Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-(4-imidazol-1-ylbenzyl)-3-isopropyl-piperazin-2-one Formula: C27H27ClN4O3S MolecularWeight: 523.04628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

CC(C)C1C(=O)N(CCN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C27H27ClN4O3S/c1-19(2)26-27(33)30(17-20-3-8-24(9-4-20)31-12-11-29-18-31)13-14-32(26)36(34,35)25-10-6-21-15-23(28)7-5-22(21)16-25/h3-12,15-16,18-19,26H,13-14,17H2,1-2H3