[4-(6-bromanylnaphthalen-2-yl)sulfonyl-3-(4-pyrimidin-4-ylphenyl)carbonyl-piperazin-2-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [4-(6-bromanylnaphthalen-2-yl)sulfonyl-3-(4-pyrimidin-4-ylphenyl)carbonyl-piperazin-2-yl]-thiomorpholin-4-yl-methanone Openeye Name: [4-[(6-bromo-2-naphthyl)sulfonyl]-3-(4-pyrimidin-4-ylbenzoyl)piperazin-2-yl]-thiomorpholino-methanone CAS Name: [4-[(6-bromo-2-naphthalenyl)sulfonyl]-3-[oxo-[4-(4-pyrimidinyl)phenyl]methyl]-2-piperazinyl]-thiomorpholin-4-ylmethanone IUPAC Name: [4-(6-bromonaphthalen-2-yl)sulfonyl-3-(4-pyrimidin-4-ylbenzoyl)piperazin-2-yl]-thiomorpholin-4-ylmethanone Traditional Name: [4-[(6-bromo-2-naphthyl)sulfonyl]-3-[4-(4-pyrimidyl)benzoyl]piperazin-2-yl]-thiomorpholino-methanone Formula: C30H28BrN5O4S2 MolecularWeight: 666.60842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(N1)C(=O)N2CCSCC2)C(=O)C3=CC=C(C=C3)C4=NC=NC=C4)S(=O)(=O)C5=CC6=C(C=C5)C=C(C=C6)Br

Isomeric SMILES

C1CN(C(C(N1)C(=O)N2CCSCC2)C(=O)C3=CC=C(C=C3)C4=NC=NC=C4)S(=O)(=O)C5=CC6=C(C=C5)C=C(C=C6)Br

InChI

InChI=1S/C30H28BrN5O4S2/c31-24-7-5-23-18-25(8-6-22(23)17-24)42(39,40)36-12-11-33-27(30(38)35-13-15-41-16-14-35)28(36)29(37)21-3-1-20(2-4-21)26-9-10-32-19-34-26/h1-10,17-19,27-28,33H,11-16H2