1-[5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanylpentanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanylpentanoyl]piperidine-4-carboxamide Openeye Name: 1-[5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanylpentanoyl]piperidine-4-carboxamide CAS Name: 1-[5-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-1-oxopentyl]-4-piperidinecarboxamide IUPAC Name: 1-[5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanylpentanoyl]piperidine-4-carboxamide Traditional Name: 1-[5-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]pentanoyl]isonipecotamide Formula: C24H31BrN4O3S MolecularWeight: 535.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)N2CCC(CC2)C(=O)N)C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)N2CCC(CC2)C(=O)N)C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H31BrN4O3S/c1-16-20(15-17-6-8-19(25)9-7-17)23(32)28(2)24(27-16)33-14-4-3-5-21(30)29-12-10-18(11-13-29)22(26)31/h6-9,18H,3-5,10-15H2,1-2H3,(H2,26,31)