[2-(4-bromophenyl)sulfonyl-4-pyridin-4-yl-piperidin-1-yl]-piperazin-1-yl-methanone

Systemtic Name: [2-(4-bromophenyl)sulfonyl-4-pyridin-4-yl-piperidin-1-yl]-piperazin-1-yl-methanone Openeye Name: [2-(4-bromophenyl)sulfonyl-4-(4-pyridyl)-1-piperidyl]-piperazin-1-yl-methanone CAS Name: [2-(4-bromophenyl)sulfonyl-4-pyridin-4-yl-1-piperidinyl]-(1-piperazinyl)methanone IUPAC Name: [2-(4-bromophenyl)sulfonyl-4-pyridin-4-ylpiperidin-1-yl]-piperazin-1-ylmethanone Traditional Name: [2-brosyl-4-(4-pyridyl)piperidino]-piperazino-methanone Formula: C21H25BrN4O3S MolecularWeight: 493.4172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C(=O)N4CCNCC4

Isomeric SMILES

C1CN(C(CC1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C(=O)N4CCNCC4

InChI

InChI=1S/C21H25BrN4O3S/c22-18-1-3-19(4-2-18)30(28,29)20-15-17(16-5-8-23-9-6-16)7-12-26(20)21(27)25-13-10-24-11-14-25/h1-6,8-9,17,20,24H,7,10-15H2