5-bromanyl-3-methylsulfonyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole

Systemtic Name: 5-bromanyl-3-methylsulfonyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole Openeye Name: 5-bromo-3-methylsulfonyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole CAS Name: 5-bromo-3-methylsulfonyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole IUPAC Name: 5-bromo-3-methylsulfonyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole Traditional Name: 5-bromo-3-mesyl-1-(1,4,5,6-tetrahydropyrimidin-2-ylmethyl)indole Formula: C14H16BrN3O2S MolecularWeight: 370.26474

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN(C2=C1C=C(C=C2)Br)CC3=NCCCN3

Isomeric SMILES

CS(=O)(=O)C1=CN(C2=C1C=C(C=C2)Br)CC3=NCCCN3

InChI

InChI=1S/C14H16BrN3O2S/c1-21(19,20)13-8-18(9-14-16-5-2-6-17-14)12-4-3-10(15)7-11(12)13/h3-4,7-8H,2,5-6,9H2,1H3,(H,16,17)